Hydrochloric Acid

Hydrochloric Acid

SCHEMBL183997

CC(I)N=C=NCCCN(C)C.Cl

nearest known ligand 0.53

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 5)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.53
CYP2D6 P10635 1/20 0.53
ALDH1A1 P00352 2/20 0.31
TSHR P16473 1/20 0.31
DNM1 Q05193 1/20 0.30

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
SCHEMBL1046361 0.98 CYP1A2 (0.55) CYP1A2CYP2D6ALDH1A1TSHR
Hydrochloric Acid SCHEMBL10619074 0.85 CYP1A2 (0.57) CYP1A2CYP2D6ALDH1A1TSHRDNM1
SCHEMBL3275536 0.82 CYP1A2 (0.59) CYP1A2CYP2D6ALDH1A1TSHRDNM1
Hydrochloric Acid SCHEMBL4292279 0.81 CYP1A2 (0.53) CYP1A2CYP2D6ALDH1A1TSHRDNM1
Hydrochloric Acid SCHEMBL3915191 0.80 CYP1A2 (0.56) CYP1A2CYP2D6ALDH1A1TSHRDNM1
SCHEMBL3832951 0.78 CYP1A2 (0.58) CYP1A2CYP2D6ALDH1A1TSHRDNM1
SCHEMBL3830223 0.77 CYP1A2 (0.82) CYP1A2CYP2D6ALDH1A1TSHRDNM1
Hydrochloric Acid SCHEMBL28536401 0.76 CYP1A2 (0.51) CYP1A2CYP2D6DNM1
Hydrochloric Acid SCHEMBL29150638 0.76 CYP1A2 (0.47) CYP1A2CYP2D6ALDH1A1
Hydrochloric Acid SCHEMBL381021 0.74 CYP1A2 (0.63) CYP1A2CYP2D6ALDH1A1TSHRDNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210300917-A1 Solid State Forms of an Apoptosis-Inducing Agent and Processes Thereof LUPIN LTD (IN) 2021-09-30 US claimed
WO-2018104953-A1 IMPROVED PROCESS FOR THE PREPARATION OF 7-{4-[4-(2,3-DICHLOROPHENYL)-PIPERAZIN-1-YL]BUTOXY}-2OXO-3,4-DIHYDRO-2H-QUINOLIN-1-YL)METHYL DODECANOATE MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2018-06-14 WO claimed
EP-0189305-A2 Peptide derivatives ICI AMERICAS INC. (US) 1986-07-30 EP claimed
US-20260079155-A1 FABRICATION OF FLUORESCENT NANOPARTICLES AND THEIR CONJUGATES FOR IN VITRO AND IN VIVO DIAGNOSTICS AUISET BIOTECHNOLOGY CO LTD (CN) 2026-03-19 US disclosed
US-20250325186-A1 Implantable Imagers for in Vivo Imaging UNIV CALIFORNIA (US) 2025-10-23 US disclosed
US-12384748-B2 Modulators of mas-related g-protein receptor X2 and related products and methods ESCIENT PHARMACEUTICALS, INC. (US) 2025-08-12 US disclosed
US-20240393323-A1 Microfluidic Magnetic Separation Device with A Magnetophoretic Gradient for Isolation of Target Cell Populations from Fluid Samples THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2024-11-28 US disclosed
US-20240351987-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS AND METHODS ESCIENT PHARMACEUTICALS INC (US) 2024-10-24 US disclosed
US-20240336570-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS AND METHODS ESCIENT PHARMACEUTICALS INC (US) 2024-10-10 US disclosed
US-20240239749-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS AND METHODS ESCIENT PHARMACEUTICALS INC (US) 2024-07-18 US disclosed
WO-2024118297-A1 BIOPROSTHETIC TISSUE AND PROSTHETIC ANTIMICROBIAL TREATMENT EDWARDS LIFESCIENCES CORPORATION (US) 2024-06-06 WO disclosed
EP-0635014-A1 INDOLE DERIVATIVES AS 5-HT1-LIKE AGONISTS. PFIZER LTD (GB) 1995-01-25 EP disclosed
US-5310922-A Squaraine dyes SYNTEX (U.S.A.) INC. (US) 1994-05-10 US disclosed
EP-0567026-A1 4,1-Benzoxazepin derivatives as squalene synthase inhibitors and their use in the treatment of hypercholesteremia and as fungicides TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-10-27 EP disclosed
EP-0526649-A1 CARBOXYMETHYLMANNOGLUCAN AND DERIVATIVE THEREOF DRUG DELIVERY SYSTEM INSTITUTE, LTD. (JP) 1993-02-10 EP disclosed
EP-0149593-B1 NOVEL THIOPEPTOLIDE SUBSTRATES FOR VERTEBRATE COLLAGENASE Monsanto Company (US) 1990-03-28 EP disclosed
EP-0284632-A1 Phenylalanine derivative and proteinase inhibitor Okamoto, Shosuke (JP) 1988-10-05 EP disclosed
EP-0244836-A2 Tripeptide derivatives Dainippon Pharmaceutical Co., Ltd. (JP) 1987-11-11 EP disclosed
EP-0238319-A1 Pyrrolidine derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1987-09-23 EP disclosed
EP-0117053-A1 Azetidinone derivatives AJINOMOTO CO., INC. (JP) 1984-08-29 EP 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 (6 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-20240351987-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS AND METHODS MRGPRX2, MRGPRX1, MRGPRX4 CYP1A2 3308/4885CYP2D6 2509/4885ALDH1A1 4827/4885
US-20260079155-A1 FABRICATION OF FLUORESCENT NANOPARTICLES AND THEIR CONJUGATES FOR IN VITRO AND IN VIVO DIAGNOSTICS NDC1, IK, SAMM50 CYP1A2 1258/4885CYP2D6 2006/4885ALDH1A1 80/4885
US-20240239749-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS AND METHODS MRGPRX2, MRGPRX1, MRGPRX4 CYP1A2 3460/4885CYP2D6 2689/4885ALDH1A1 4780/4885
US-20240336570-A1 MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR X2 AND RELATED PRODUCTS AND METHODS MRGPRX2, MRGPRX1, MRGPRX4 CYP1A2 3301/4885CYP2D6 2647/4885ALDH1A1 4805/4885
US-20210300917-A1 Solid State Forms of an Apoptosis-Inducing Agent and Processes Thereof BAX, BCL2, BAD CYP1A2 2565/4885CYP2D6 2441/4885ALDH1A1 2907/4885
US-12384748-B2 Modulators of mas-related g-protein receptor X2 and related products and methods MRGPRX2, MRGPRX1, MRGPRX4 CYP1A2 3308/4885CYP2D6 2509/4885ALDH1A1 4827/4885

“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.