SCHEMBL1003133

SCHEMBL1003133

Cc1ccc(C(N)=O)c(F)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.60
MAP2K2 P36507 1/20 0.50
MAP2K1 Q02750 1/20 0.50
LOXL2 Q9Y4K0 1/20 0.44
PARP1 P09874 1/20 0.44
CSNK2A1 P68400 1/20 0.44
GRM2 Q14416 2/20 0.43
PARP10 Q53GL7 4/20 0.43
PARP15 Q460N3 2/20 0.43
PARP14 Q460N5 1/20 0.42
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
CSF1R P07333 1/20 0.41
JAK2 O60674 1/20 0.41
F2 P00734 1/20 0.40
F10 P00742 1/20 0.40
PLG P00747 1/20 0.40
PLAU P00749 1/20 0.40
PLAT P00750 1/20 0.40
CPS1 P31327 1/20 0.40

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 SCHEMBL4090389 0.98 DGAT1 (0.58) DGAT1MAP2K2MAP2K1LOXL2PARP1
Hydrochloric Acid SCHEMBL4090387 0.96 DGAT1 (0.56) DGAT1MAP2K2MAP2K1LOXL2PARP1
Trifluoroacetic Acid SCHEMBL29693047 0.89 DGAT1 (0.50) DGAT1MAP2K2MAP2K1LOXL2PARP1
SCHEMBL1478262 0.88 MAP2K2 (0.50) DGAT1MAP2K2MAP2K1LOXL2PARP1
Hydrochloric Acid SCHEMBL28268305 0.86 MAP2K2 (0.49) DGAT1MAP2K2MAP2K1LOXL2PARP1
SCHEMBL9726681 0.83 CSNK2A1 (0.47) DGAT1MAP2K2MAP2K1LOXL2CSNK2A1
SCHEMBL489010 0.81 CSNK2A1 (0.61) LOXL2CSNK2A1
SCHEMBL29688899 0.81 KMT2A (0.46) LOXL2CSNK2A1CES2CES1CPS1
SCHEMBL1226712 0.81 KMT2A (0.46) LOXL2CSNK2A1CES2CES1CPS1
SCHEMBL24311296 0.79 PARP1 (0.44) MAP2K2MAP2K1PARP1CSNK2A1F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260138969-A1 TRIAZOLE COMPOUND HAVING NOVEL RING STRUCTURE, METHOD FOR PREPARING SAME, AND USE THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2026-05-21 US claimed
EP-4745133-A1 TRIAZOLE COMPOUND HAVING NOVEL RING STRUCTURE, METHOD FOR PREPARING SAME, AND USE THEREOF Korea Research Institute of Chemical Technology (KR) 2026-05-20 EP claimed
CN-115279759-A 3- ((8- ((1H-pyrazol-4-yl) amino) imidazo [1,2-a ] pyridin-3-yl) ethynyl) -N-phenylbenzamide derivative, preparation method thereof, and pharmaceutical composition for preventing or treating cancer containing same as active ingredient 大邱庆北尖端医疗产业振兴财团 2022-11-01 CN claimed
WO-2022149855-A1 HETEROARYL-ETHYNYL DERIVATIVE COMPOUND AND USE THEREOF 주식회사 비투에스바이오 2022-07-14 WO claimed
EP-3448850-B1 PIPERIDINYL DERIVATIVES MERCK PATENT GMBH (DE) 2020-11-04 EP claimed
US-10428024-B2 Piperidinyl derivatives MERCK PATENT GMBH (DE) 2019-10-01 US claimed
US-20190135753-A1 PIPERIDINYL DERIVATIVES MERCK PATENT GMBH (DE) 2019-05-09 US claimed
CN-105209429-B SHIP1 conditioning agents and relative method 阿奎诺克斯药物(加拿大)公司 2018-05-29 CN claimed
EP-2906559-B1 AZAINDOLINES HOFFMANN LA ROCHE (CH) 2017-02-08 EP claimed
US-9309248-B2 Azaindolines HOFFMANN-LA ROCHE INC. (US) 2016-04-12 US claimed
US-20100056460-A1 COMBINATION OF ORGANIC COMPOUNDS ALI MOHAMMED A 2010-03-04 US claimed
US-20090131447-A1 COMBINATION THERAPY XENON PHARMACEUTICALS INC. (CA) 2009-05-21 US claimed
EP-1907004-A2 COMBINATION OF A RENIN INHIBITOR AND AN INSULIN SECRETION ENHANCER OR AN INSULIN SENSITIZER Novartis AG (CH) 2008-04-09 EP claimed
US-7335658-B2 Pyridazine derivatives and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2008-02-26 US claimed
EP-1846035-A2 COMBINATION THERAPY XENON PHARMACEUTICALS INC. (CA) 2007-10-24 EP claimed
WO-2007005763-A2 COMBINATION OF A RENIN INHIBITOR AND AN INSULIN SECRETION ENHANCER OR AN INSULIN SENSITIZER NOVARTIS AG (CH) 2007-01-11 WO claimed
WO-2006086445-A2 COMBINATION THERAPY XENON PHARMACEUTICALS INC. (CA) 2006-08-17 WO claimed
US-20050065143-A1 Pyridazine derivatives and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2005-03-24 US claimed
US-20040110778-A1 Heterocyclic compounds as ligands of the GABAA receptor YOHANNES DANIEL (US) 2004-06-10 US claimed
US-20030105081-A1 Heterocyclic compounds as ligands of the GABAA receptor PFIZER INC 2003-06-05 US 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 (8 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-20030105081-A1 Heterocyclic compounds as ligands of the GABAA receptor GABRB1, GABRP, GABRA1 DGAT1 3070/4885MAP2K2 3635/4885MAP2K1 4071/4885
US-20050065143-A1 Pyridazine derivatives and their use as therapeutic agents PRDX5, SNRPD3, SNRPD2 DGAT1 4434/4885MAP2K2 4681/4885MAP2K1 4826/4885
US-20260138969-A1 TRIAZOLE COMPOUND HAVING NOVEL RING STRUCTURE, METHOD FOR PREPARING SAME, AND USE THEREOF CASP1, CASP3, BAD DGAT1 834/4885MAP2K2 69/4885MAP2K1 49/4885
US-10428024-B2 Piperidinyl derivatives PDK1, PDK2, PDK3 DGAT1 2156/4885MAP2K2 1076/4885MAP2K1 1140/4885
US-20190135753-A1 PIPERIDINYL DERIVATIVES PDK1, PDK2, PDK3 DGAT1 2156/4885MAP2K2 1076/4885MAP2K1 1140/4885
US-20040110778-A1 Heterocyclic compounds as ligands of the GABAA receptor GABRB1, GABRP, GABRA1 DGAT1 3070/4885MAP2K2 3635/4885MAP2K1 4071/4885
US-20100056460-A1 COMBINATION OF ORGANIC COMPOUNDS REN, IAPP, ACE DGAT1 1163/4885MAP2K2 1104/4885MAP2K1 658/4885
US-20090131447-A1 COMBINATION THERAPY SCD, SCD5, ARG1 DGAT1 1025/4885MAP2K2 3694/4885MAP2K1 3523/4885

“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.