Hydrochloric Acid

Hydrochloric Acid

SCHEMBL531052

Cl.Fc1ccc2c(C3CCNCC3)noc2c1

nearest known ligand 0.60

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 7)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 2/20 0.60
DRD2 known ✓ P14416 2/20 0.58
SLC6A4 known ✓ P31645 1/20 0.58
HTR2A known ✓ P28223 2/20 0.48
HTR7 known ✓ P34969 1/20 0.48
HTR2C known ✓ P28335 1/20 0.47
SCD O00767 1/20 0.50

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
SCHEMBL461287 0.99 ACHE (0.61) ACHEDRD2SLC6A4SCDHTR2A
SCHEMBL7726651 0.92 ACHE (0.55) ACHEDRD2SLC6A4HTR2AHTR2C
Hydrochloric Acid SCHEMBL1544936 0.92 ACHE (0.54) ACHEDRD2SLC6A4SCDHTR2A
SCHEMBL7356803 0.90 ACHE (0.55) ACHEDRD2SLC6A4SCDHTR2A
Hydrochloric Acid SCHEMBL8916694 0.89 SCD (0.50) ACHEDRD2SLC6A4SCD
Trifluoroacetic Acid SCHEMBL7453133 0.88 ACHE (0.51) ACHEDRD2SLC6A4HTR2AHTR7
SCHEMBL187372 0.87 SCD (0.51) ACHEDRD2SLC6A4SCD
SCHEMBL29688619 0.87 SCD (0.51) ACHEDRD2SLC6A4SCD
SCHEMBL4541441 0.87 ACHE (0.58) ACHEDRD2SLC6A4SCDHTR2A
SCHEMBL20327895 0.84 ACHE (0.56) ACHEDRD2SLC6A4SCDHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117700405-B Preparation method of 6-fluoro-3-piperidin-4-yl-1, 2-benzisoxazole hydrochloride 山东康诺生物工程有限公司 2025-04-04 CN claimed
CN-117700405-A Preparation method of 6-fluoro-3-piperidin-4-yl-1, 2-benzisoxazole hydrochloride 山东康诺生物工程有限公司 2024-03-15 CN claimed
CN-115109056-A Preparation method of paliperidone 常州市第四制药厂有限公司 2022-09-27 CN claimed
CN-112830922-B Preparation method of paliperidone intermediate 常州恒邦药业有限公司 2022-04-15 CN claimed
CN-111393425-B Preparation method of 6-fluoro-3-piperidine-4-yl-1, 2-benzisoxazole hydrochloride 浙江京新药业股份有限公司 2021-11-26 CN claimed
CN-111777601-B Preparation method of 6-fluoro-3- (4-piperidyl) -1, 2 benzisoxazole hydrochloride 白银京宇新药业有限公司 2021-07-16 CN claimed
CN-112830922-A Preparation method of paliperidone intermediate 常州恒邦药业有限公司 2021-05-25 CN claimed
CN-112624992-A Purification method of 6-fluoro-3- (4-piperidyl) -1, 2-benzisoxazole hydrochloride 浙江华海药业股份有限公司 2021-04-09 CN claimed
CN-111777601-A Preparation method of 6-fluoro-3- (4-piperidyl) -1, 2 benzisoxazole hydrochloride 白银京宇新药业有限公司 2020-10-16 CN claimed
CN-111393425-A Preparation method of 6-fluoro-3-piperidine-4-yl-1, 2-benzisoxazole hydrochloride 浙江京新药业股份有限公司 2020-07-10 CN claimed
US-20120172600-A1 METHOD FOR PREPARATION OF ILOPERIDONE AND CRYSTALLIZATION METHOD THEREOF ZHEJIANG HUAHAI PHARMACEUTICAL CO., LTD. (CN) 2012-07-05 US claimed
US-20120164188-A1 PALIPERIDONE OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF SUBSTANTIALLY FREE OF IMPURITIES ACTAVIS GROUP PTC EHF (IS) 2012-06-28 US claimed
WO-2012035554-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF HIGHLY PURE PALIPERIDONE MEGAFINE PHARMA (P) LTD. (IN) 2012-03-22 WO claimed
US-20110293889-A1 NOVEL AND IMPROVED PROCESSES FOR THE PREPARATION OF PALIPERIDONE MSN LABORATORIES LIMITED (IN) 2011-12-01 US claimed
US-20100311969-A1 Process For Preparation of Paliperidone Watson Pharma Private Limited (IN) 2010-12-09 US claimed
WO-2010082110-A2 NOVEL PROCESS FOR PREPARING PURE 6-FLUORO-3-PIPERIDIN-4-YL-1,2-BENZISOXAZOLE HYDROCHLORIDE AND ITS CONVERSION TO PALIPERIDONE CADILA PHARMACEUTICALS LTD (IN) 2010-07-22 WO claimed
US-20100130740-A1 PROCESS FOR PREPARATION OF RISPERIDONE QILU PHARMACEUTICAL CO. LTD. (CN) 2010-05-27 US claimed
US-20070179163-A1 Process for the preparation of risperidone JUBILANT ORGANOSYS LTD. (IN) 2007-08-02 US claimed
EP-1670797-A1 PROCESS FOR THE PREPARATION OF RISPERIDONE Jubilant Organosys Limited (IN) 2006-06-21 EP claimed
WO-2005030772-A1 PROCESS FOR THE PREPARATION OF RISPERIDONE JUBILANT ORGANOSYS LTD. (IN) 2005-04-07 WO claimed

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-20120172600-A1 METHOD FOR PREPARATION OF ILOPERIDONE AND CRYSTALLIZATION METHOD THEREOF FAP, FIBP, FIP1L1 ACHE 2487/4885DRD2 4534/4885SLC6A4 4499/4885
US-20070179163-A1 Process for the preparation of risperidone CYP2C19, HTR1A, CYP3A7 ACHE 1910/4885DRD2 193/4885SLC6A4 573/4885
US-20100130740-A1 PROCESS FOR PREPARATION OF RISPERIDONE CYP3A7, CYP2C19, HTR7 ACHE 726/4885DRD2 141/4885SLC6A4 434/4885
US-20100311969-A1 Process For Preparation of Paliperidone FIP1L1, HTR3C, HTR4 ACHE 4192/4885DRD2 87/4885SLC6A4 390/4885
US-20110293889-A1 NOVEL AND IMPROVED PROCESSES FOR THE PREPARATION OF PALIPERIDONE AVPR2, AVPR1B, AVPR1A ACHE 4692/4885DRD2 307/4885SLC6A4 541/4885
US-20120164188-A1 PALIPERIDONE OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF SUBSTANTIALLY FREE OF IMPURITIES REN, DHPS, AVPR2 ACHE 4730/4885DRD2 704/4885SLC6A4 1035/4885

“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.