Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1024982

COc1cccc(N2CCNCC2)c1.Cl.Cl

nearest known ligand 0.97

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
ADRB1 known ✓ P08588 5/20 0.97
HTR2C known ✓ P28335 3/20 0.65
HTR1A known ✓ P08908 6/20 0.65
HTR1D known ✓ P28221 1/20 0.65
HTR1B known ✓ P28222 1/20 0.65
HTR3A known ✓ P46098 4/20 0.64
HTR3E known ✓ A5X5Y0 2/20 0.64
HTR3B known ✓ O95264 2/20 0.64
HTR3D known ✓ Q70Z44 2/20 0.64
HTR3C known ✓ Q8WXA8 2/20 0.64
SIGMAR1 known ✓ Q99720 2/20 0.64
HTR7 known ✓ P34969 5/20 0.61
HTR2A known ✓ P28223 3/20 0.57
HTR6 known ✓ P50406 3/20 0.57
HTR2B known ✓ P41595 2/20 0.57
DRD2 known ✓ P14416 2/20 0.57
SLC6A4 known ✓ P31645 1/20 0.57
NPC1 O15118 1/20 0.58
MAPT P10636 1/20 0.58
TP53 P04637 1/20 0.57

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
Hydrochloric Acid SCHEMBL7757785 1.00 ADRB1 (0.97) ADRB1HTR2CHTR1AHTR1DHTR1B
Hydrochloric Acid SCHEMBL1706127 1.00 ADRB1 (0.97) ADRB1HTR2CHTR1AHTR1DHTR1B
SCHEMBL7838014 0.98 ADRB1 (1.00) ADRB1HTR2CHTR1AHTR1DHTR1B
SCHEMBL379449 0.98 ADRB1 (1.00) ADRB1HTR2CHTR1AHTR1DHTR1B
SCHEMBL5669070 0.97 ADRB1 (0.97) ADRB1HTR2CHTR1AHTR1DHTR1B
Bromide SCHEMBL27617608 0.97 ADRB1 (0.97) ADRB1HTR2CHTR1AHTR1DHTR1B
Bromide SCHEMBL4875933 0.97 ADRB1 (0.97) ADRB1HTR2CHTR1AHTR1DHTR1B
Piperazine SCHEMBL28092166 0.97 ADRB1 (0.97) ADRB1HTR2CHTR1AHTR1DHTR1B
SCHEMBL4526848 0.92 ADRB1 (0.88) ADRB1HTR2CHTR1AHTR1DHTR1B
SCHEMBL11074672 0.85 ADRB1 (0.76) ADRB1NPC1MAPTDRD2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0091511-A2 1-(3-(6-Fluoro-1,2-benzisoxazol-3-yl)propyl)-4-(substituted)-piperazines and -piperidines, a process for the preparation thereof, pharmaceutical compositions containing the same and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1983-10-19 EP claimed
CN-119798172-A Preparation method of Leitemivir key intermediate dihydroquinazoline ester 仁合益康集团有限公司 2025-04-11 CN disclosed
CN-118084807-A Refining method of 3, 4-dihydro quinazoline compound 南京正大天晴制药有限公司 2024-05-28 CN disclosed
US-11851435-B2 PTGR2 inhibitors and their use NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2023-12-26 US disclosed
US-20230279008-A1 PTGR2 INHIBITORS AND THEIR USE NATIONAL TAIWAN UNIVERSITY (TW) 2023-09-07 US disclosed
CN-115850192-A Process for preparing 3,4-dihydroquinazoline derivatives 南京正大天晴制药有限公司 2023-03-28 CN disclosed
US-9670202-B2 Substituted triazolopyridines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-06-06 US disclosed
CN-105408332-B Substituted triazolopyridines 拜耳制药股份公司 2017-05-10 CN disclosed
EP-3004092-B1 SUBSTITUTED TRIAZOLOPYRIDINES Bayer Pharma AG (DE) 2017-03-22 EP disclosed
US-9555022-B2 Substituted triazolopyridines BAYER INTELLECTUAL PROPERTY GMBH (DE) 2017-01-31 US disclosed
EP-0316723-A1 3-[4(1-Substituted-4-piperazinyl)butyl]-4-thiazolidinones a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1989-05-24 EP disclosed
EP-0091511-B1 1-(3-(6-FLUORO-1,2-BENZISOXAZOL-3-YL)PROPYL)-4-(SUBSTITUTED)-PIPERAZINES AND -PIPERIDINES, A PROCESS FOR THE PREPARATION THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND THEIR USE AS MEDICAMENTS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1988-05-11 EP disclosed
US-4707550-A N-(substituted thienyl)-N'-(substituted piperazinyl)-ureas ORTHO PHARMACEUTICAL CORPORATION (US) 1987-11-17 US disclosed
EP-0244176-A2 Thienopyrimidine-2,4-dione derivatives and intermediates thereof ORTHO PHARMACEUTICAL CORPORATION (US) 1987-11-04 EP disclosed
US-4670560-A VASODILATING AGENTS, HYPOTENSIVE AGENTS AND/OR CARDIOVASCULAR AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1987-06-02 US disclosed
US-4610988-A HYPOTENSIVE AGENTS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1986-09-09 US disclosed
US-4609658-A ANTIPSYCHOTIC, ANALGESIC HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1986-09-02 US disclosed
US-4604395-A NERVOUS SYSTEM DISORDERS, ANALGESICS, HYPOTENSIVE AGENTS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1986-08-05 US disclosed
US-4536578-A ANTIHALLUCINOGENS, HYPOTENSIVE AGENTS HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1985-08-20 US disclosed
US-4140775-A HYPOTENSIVE AGENTS THE UPJOHN COMPANY (US) 1979-02-20 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 (2 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-11851435-B2 PTGR2 inhibitors and their use PTGFR, PTGIR, PTGDR2 ADRB1 128/4885HTR2C 341/4885HTR1A 294/4885
US-20230279008-A1 PTGR2 INHIBITORS AND THEIR USE PTGFR, PTGIR, PTGDR2 ADRB1 128/4885HTR2C 341/4885HTR1A 294/4885

“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.