Nipecotic Acid

Nipecotic Acid

SCHEMBL193736

Cl.O=C(O)C1CCCNC1

nearest known ligand 0.95

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 Nipecotic 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
SLC6A1 known ✓ P30531 3/20 0.95
GABRA5 known ✓ P31644 2/20 0.50
GABRB2 known ✓ P47870 2/20 0.50
GABRP known ✓ O00591 1/20 0.50
GABRD known ✓ O14764 1/20 0.50
GABRA1 known ✓ P14867 1/20 0.50
GABRB1 known ✓ P18505 1/20 0.50
GABRG2 known ✓ P18507 1/20 0.50
GABRB3 known ✓ P28472 1/20 0.50
GABRA3 known ✓ P34903 1/20 0.50
GABRA2 known ✓ P47869 1/20 0.50
GABRA4 known ✓ P48169 1/20 0.50
GABRE known ✓ P78334 1/20 0.50
GABRA6 known ✓ Q16445 1/20 0.50
GABRG1 known ✓ Q8N1C3 1/20 0.50
GABRG3 known ✓ Q99928 1/20 0.50
GABRQ known ✓ Q9UN88 1/20 0.50
TSHR P16473 2/20 0.95
SLC6A11 P48066 2/20 0.95
SLC6A13 Q9NSD5 2/20 0.95

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
Nipecotic Acid SCHEMBL15971488 1.00 SLC6A1 (0.95) SLC6A1TSHRSLC6A11SLC6A13LMNA
(S)-Nipecotic Acid SCHEMBL193735 1.00 SLC6A1 (0.95) SLC6A1TSHRSLC6A11SLC6A13LMNA
(R)-Nipecotic Acid SCHEMBL20562073 1.00 SLC6A1 (0.95) SLC6A1TSHRSLC6A11SLC6A13LMNA
Nipecotic Acid SCHEMBL28258365 0.98 SLC6A1 (0.91) SLC6A1TSHRSLC6A11SLC6A13LMNA
Nipecotic Acid SCHEMBL85677 0.98
(R)-Nipecotic Acid SCHEMBL520075 0.98
(S)-Nipecotic Acid SCHEMBL254683 0.98
(R)-Nipecotic Acid SCHEMBL29880539 0.98
Nipecotic Acid SCHEMBL456856 0.98 SLC6A1 (1.00) SLC6A1TSHRSLC6A11SLC6A13LMNA
Nipecotic Acid SCHEMBL17743427 0.95 SLC6A1 (0.95) SLC6A1TSHRSLC6A11SLC6A13LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016102969-A1 INHIBITION OF HAIR GROWTH THE UNIVERSITY OF MANCHESTER (GB) 2016-06-30 WO claimed
US-20240174635-A1 TLR 9 INHIBITORS INSILICO MEDICINE IP LIMITED (HK) 2024-05-30 US disclosed
CN-111918651-B GCN2 inhibitors and uses thereof 默克专利股份有限公司 2024-01-30 CN disclosed
CN-117460718-A Triazine derivatives and their use in the treatment of cancer 豪夫迈·罗氏有限公司 2024-01-26 CN disclosed
US-11807622-B2 TLR 9 inhibitors INSILICO MEDICINE IP LIMITED (HK) 2023-11-07 US disclosed
WO-2022002078-A1 OXADIAZOLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF 中国科学院上海药物研究所 2022-01-06 WO disclosed
US-20210253553-A1 TLR 9 INHIBITORS INSILICO MEDICINE IP LIMITED (HK) 2021-08-19 US disclosed
CN-113248492-A Heterocycle substituted nitrogen-containing six-membered heterocycle derivative, preparation method and medical application thereof 上海海雁医药科技有限公司 2021-08-13 CN disclosed
US-10688080-B2 Compositions, methods of use, and methods of treatment UNIVERSITY OF SOUTH FLORIDA (US) 2020-06-23 US disclosed
CN-108535398-B Method for separating tiagabine hydrochloride chiral enantiomer by adopting reversed-phase high-performance liquid chromatography 福州海王福药制药有限公司 2020-03-27 CN disclosed
EP-1758580-A2 N-SUBSTITUTED PIPERIDINES AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-03-07 EP disclosed
CN-1898206-A Allosteric modulators of metabotropic glutamate receptors ADDEX PHARMACEUTICALS SA (CH) 2007-01-17 CN disclosed
EP-1685105-A1 ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Addex Pharmaceuticals SA (CH) 2006-08-02 EP disclosed
WO-2006046031-A1 PHARMACEUTICAL COMPOUNDS PIRAMED LIMITED (GB) 2006-05-04 WO disclosed
WO-2006012226-A2 N-SUBSTITUTED PIPERIDINES AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-02-02 WO disclosed
WO-2005044797-A1 ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMACEUTICALS SA (CH) 2005-05-19 WO disclosed
CN-1225094-A Improved forms of R (-) -N- (4, 4-di (3-methylthiophen-2-yl) but-3-enyl) -3-piperidinecarboxylic acid hydrochloride NOVO NORDISK AS (DK) 1999-08-04 CN disclosed
EP-0858339-A1 A METHOD OF TREATING FILARIAE NOVO NORDISK A/S (DK) 1998-08-19 EP disclosed
WO-1997017073-A1 A METHOD OF TREATING FILARIAE NOVO NORDISK A/S (DK) 1997-05-15 WO disclosed
US-4971958-A CALCIUM METABOLISM BOEHRINGER MANNHEIM GMBH (DE) 1990-11-20 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 (4 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-10688080-B2 Compositions, methods of use, and methods of treatment LIPA, LCT, GAA SLC6A1 2182/4885GABRA5 1953/4885GABRB2 1650/4885
US-20210253553-A1 TLR 9 INHIBITORS TLR9, TLR1, TLR7 SLC6A1 3391/4885GABRA5 1879/4885GABRB2 2616/4885
US-11807622-B2 TLR 9 inhibitors TLR9, TLR1, TLR7 SLC6A1 3391/4885GABRA5 1879/4885GABRB2 2616/4885
US-20240174635-A1 TLR 9 INHIBITORS TLR9, TLR1, TLR7 SLC6A1 3391/4885GABRA5 1879/4885GABRB2 2616/4885

“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.