Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8615487

CC(C)c1cccc(C(C)C)c1N.Cl

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 known ✓ P14867 3/20 0.52
GABRG2 known ✓ P18507 2/20 0.52
GABRB3 known ✓ P28472 2/20 0.52
GABRB2 known ✓ P47870 2/20 0.52
CA2 known ✓ P00918 1/20 0.52
GABRB1 known ✓ P18505 1/20 0.52
PTGS1 known ✓ P23219 1/20 0.52
SLC6A2 known ✓ P23975 1/20 0.52
HTR2C known ✓ P28335 1/20 0.52
GABRA5 known ✓ P31644 1/20 0.52
GABRA3 known ✓ P34903 1/20 0.52
HTR2B known ✓ P41595 1/20 0.52
GABRA2 known ✓ P47869 1/20 0.52
GABRA4 known ✓ P48169 1/20 0.52
GABRA6 known ✓ Q16445 1/20 0.52
GLA known ✓ P06280 1/20 0.41
LMNA P02545 3/20 0.52
CYP1A2 P05177 2/20 0.52
CYP3A4 P08684 2/20 0.52
FAAH O00519 1/20 0.52

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL104314 0.97 GABRA1 (0.55) GABRA1LMNAGABRG2GABRB3GABRB2
Lithium Ion SCHEMBL29536467 0.94 GABRA1 (0.52) GABRA1LMNAGABRG2GABRB3GABRB2
SCHEMBL6692957 0.94 GABRA1 (0.52) GABRA1LMNAGABRG2GABRB3GABRB2
Methane SCHEMBL27577653 0.94 GABRA1 (0.52) GABRA1LMNAGABRG2GABRB3GABRB2
SCHEMBL30791052 0.94 GABRA1 (0.52) GABRA1LMNAGABRG2GABRB3GABRB2
Lithium SCHEMBL30421854 0.94 GABRA1 (0.52) GABRA1LMNAGABRG2GABRB3GABRB2
Cyclohexane SCHEMBL27557640 0.90 GABRA1 (0.48) GABRA1LMNAGABRG2GABRB3GABRB2
Propane SCHEMBL27557470 0.90 GABRA1 (0.48) GABRA1LMNAGABRG2GABRB3GABRB2
SCHEMBL14081995 0.87 GABRA1 (0.52) GABRA1LMNAGABRG2GABRB3GABRB2
SCHEMBL28105462 0.87 LMNA (0.46) GABRA1LMNAGABRG2GABRB3GABRB2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220162160-A1 SOLID DRUG FORM OF N-(2,6-BIS(1-METHYLETHYL)PHENYL)-N'-((1-(4-(DIMETHYLAMINO)PHENYL)CYCLOPENTYL)METHYL)UREA HYDROCHLORIDE AND COMPOSITIONS, METHODS AND KITS RELATED THERETO MILLENDO THERAPEUTICS, INC. 2022-05-26 US claimed
US-20200255372-A1 SOLID DRUG FORM OF N-(2,6-BIS(1-METHYLETHYL)PHENYL)-N'-((1-(4-(DIMETHYLAMINO)PHENYL)CYCLOPENTYL)METHYL)UREA HYDROCHLORIDE AND COMPOSITIONS, METHODS AND KITS RELATED THERETO MILLENDO THERAPEUTICS INC (US) 2020-08-13 US claimed
EP-3197435-A1 SOLID DRUG FORM OF N-(2,6-BIS(1-METHYLETHYL)PHENYL)-N'-((1-(4-(DIMETHYLAMINO)PHENYL)CYCLOPENTYL) METHYL)UREA HYDROCHLORIDE AND COMPOSITIONS, METHODS AND KITS RELATED THERETO Millendo Therapeutics, Inc. (US) 2017-08-02 EP claimed
WO-2016049518-A1 SOLID DRUG FORM OF N-(2,6-BIS(1-METHYLETHYL)PHENYL)-N'-((1-(4-(DIMETHYLAMINO)PHENYL)CYCLOPENTYL) METHYL)UREA HYDROCHLORIDE AND COMPOSITIONS, METHODS AND KITS RELATED THERETO MILLENDO THERAPEUTICS, INC. (US) 2016-03-31 WO claimed
US-20160090354-A1 SOLID DRUG FORM OF N-(2,6-BIS(1-METHYLETHYL)PHENYL)-N'-((1-(4-(DIMETHYLAMINO)PHENYL)CYCLOPENTYL)METHYL)UREA HYDROCHLORIDE AND COMPOSITIONS, METHODS AND KITS RELATED THERETO THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2016-03-31 US claimed
JP-2040348-A None JP disclosed
CN-122010847-A Synthesis method of 1- [3, 5-bis (1-methylethyl) [1,1' -biphenyl ] -4-yl ] -2-bromo-1H-benzimidazole 安徽大学 2026-05-12 CN disclosed
US-20250115591-A1 NOVEL SULFONAMIDE CARBOXAMIDE COMPOUNDS INFLAZOME LTD (IE) 2025-04-10 US disclosed
US-12151998-B2 Solid drug form of N-(2,6-bis(1-methylethyl)phenyl)-N′-((1-(4-(dimethylamino)phenyl)cyclopentyl)methyl)urea hydrochloride and compositions, methods and kits related thereto THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-11-26 US disclosed
US-11981667-B2 Sulfonamide carboxamide compounds INFLAZOME LIMITED (IE) 2024-05-14 US disclosed
CN-111018718-B Preparation method of halogen substituted alkylaniline 青岛凯源祥化工有限公司 2023-02-07 CN disclosed
US-20230037255-A1 NOVEL SULFONAMIDE CARBOXAMIDE COMPOUNDS INFLAZOME LTD (IE) 2023-02-02 US disclosed
EP-0588608-A2 Tricyclic compounds and pharmaceutical compositions containing them KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-03-23 EP disclosed
EP-0347380-B1 PROCESS FOR THE PREPARATION OF 4-BROMOANILINE-HYDROBROMIDE CIBA-GEIGY AG (CH) 1993-02-10 EP disclosed
US-5055616-A 9,9-bis(3-alkyl-4-amino-5-isopropylphenyl) fluorene; for use in gas separation membranes AIR PRODUCTS AND CHEMICALS, INC. (US) 1991-10-08 US disclosed
US-5045093-A Gas separating membranes from polyimide polymers and a process for using the same AIR PRODUCTS AND CHEMICALS, INC. (US) 1991-09-03 US disclosed
US-4918230-A BROMINATION OF ANILINE HYDROHALIDE; BY-PRODUCT INHIBITION CIBA-GEIGY CORPORATION (US) 1990-04-17 US disclosed
JP-H0240348-A PREPARATION OF 4-BROMOANILINE HYDROBROMIDE CIBA GEIGY AG 1990-02-09 JP disclosed
EP-0347380-A1 Process for the preparation of 4-Bromoaniline-hydrobromide CIBA-GEIGY AG (CH) 1989-12-20 EP disclosed
US-4289906-A Chemical process for preparing methylene bis-anilines ETHYL CORPORATION (US) 1981-09-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160090354-A1 SOLID DRUG FORM OF N-(2,6-BIS(1-METHYLETHYL)PHENYL)-N'-((1-(4-(DIMETHYLAMINO)PHENYL)CYCLOPENTYL)METHYL)UREA HYDROCHLORIDE AND COMPOSITIONS, METHODS AND KITS RELATED THERETO ATR, BAP1, ATRIP GABRA1 1296/4885GABRG2 1706/4885GABRB3 1890/4885
US-12151998-B2 Solid drug form of N-(2,6-bis(1-methylethyl)phenyl)-N′-((1-(4-(dimethylamino)phenyl)cyclopentyl)methyl)urea hydrochloride and compositions, methods and kits related thereto ATR, BAP1, ATRIP GABRA1 1291/4885GABRG2 1701/4885GABRB3 1864/4885
US-20220162160-A1 SOLID DRUG FORM OF N-(2,6-BIS(1-METHYLETHYL)PHENYL)-N'-((1-(4-(DIMETHYLAMINO)PHENYL)CYCLOPENTYL)METHYL)UREA HYDROCHLORIDE AND COMPOSITIONS, METHODS AND KITS RELATED THERETO ATR, BAP1, ATRIP GABRA1 1296/4885GABRG2 1706/4885GABRB3 1890/4885
US-20200255372-A1 SOLID DRUG FORM OF N-(2,6-BIS(1-METHYLETHYL)PHENYL)-N'-((1-(4-(DIMETHYLAMINO)PHENYL)CYCLOPENTYL)METHYL)UREA HYDROCHLORIDE AND COMPOSITIONS, METHODS AND KITS RELATED THERETO ATR, BAP1, ATRIP GABRA1 1296/4885GABRG2 1706/4885GABRB3 1890/4885
US-11981667-B2 Sulfonamide carboxamide compounds NLRP3, NOD1, PYCARD GABRA1 2480/4885GABRG2 2970/4885GABRB3 1960/4885
US-20250115591-A1 NOVEL SULFONAMIDE CARBOXAMIDE COMPOUNDS NLRP3, NOD1, NLRP1 GABRA1 2534/4885GABRG2 2986/4885GABRB3 1851/4885
US-20230037255-A1 NOVEL SULFONAMIDE CARBOXAMIDE COMPOUNDS NLRP3, NOD1, NLRP1 GABRA1 2736/4885GABRG2 3122/4885GABRB3 2058/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.