SCHEMBL929327

SCHEMBL929327

COc1ccc(C(F)(F)F)nc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.52
KDM4E B2RXH2 3/20 0.44
MAPT P10636 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CHRNB2 P17787 1/20 0.43
CHRNA4 P43681 1/20 0.43
PDE10A Q9Y233 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.42
AHR P35869 1/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
NFE2L2 Q16236 2/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 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
SCHEMBL31130640 0.98 TRPV4 (0.50) TRPV4KDM4EMAPTL3MBTL1CHRNB2
SCHEMBL28514328 0.86 TRPV4 (0.47) TRPV4KDM4EMAPTL3MBTL1CHRNB2
SCHEMBL30947604 0.86 HSD11B1 (0.39) TRPV4KDM4EMAPTL3MBTL1AHR
SCHEMBL9155754 0.85 KDM4E (0.49) TRPV4KDM4EMAPTPDE10APTGS1
SCHEMBL31414063 0.85 KDM4E (0.49) TRPV4KDM4EMAPTPDE10APTGS1
SCHEMBL25227094 0.84 CA12 (0.37) TRPV4KDM4EMAPTL3MBTL1AHR
SCHEMBL16838845 0.83 MRGPRX4 (0.53) MRGPRX4SMN1; SMN2
SCHEMBL1511036 0.82 HSD11B1 (0.41) TRPV4KDM4EMAPTL3MBTL1AHR
SCHEMBL2078315 0.81 CHRNB2 (0.46) TRPV4KDM4EMAPTL3MBTL1CHRNB2
SCHEMBL10220768 0.81 CA12 (0.42) MAPTKMT2AMEN1CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105209453-A Methylene linked quinolinyl modulators of ROR-gamma-T JANSSEN PHARMACEUTICA NV 2015-12-30 CN claimed
EP-4676480-A1 INHIBITORS OF DNA POLYMERASE THETA Breakpoint Therapeutics GmbH (DE) 2026-01-14 EP disclosed
US-12441725-B2 ISO-citrate dehydrogenase (IDH) inhibitor ZHEJIANG METON PHARMACEUTICAL CO., LTD (CN) 2025-10-14 US disclosed
US-20250122221-A1 SIX-MEMBERED CYCLOTHIAZOLE COMPOUND AND USE THEREOF NANJING ZAIMING PHARMACEUTICAL CO., LTD. (CN) 2025-04-17 US disclosed
US-20250092016-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CORONAVIRAL RELATED DISEASES NOVARTIS AG (CH) 2025-03-20 US disclosed
US-12162895-B2 DNA polymerase theta inhibitor for treatment of cancer BREAKPOINT THERAPEUTICS GMBH (DE) 2024-12-10 US disclosed
EP-4464709-A1 SIX-MEMBERED CYCLOTHIAZOLE COMPOUND AND USE THEREOF Nanjing Zaiming Pharmaceutical Co., Ltd. (CN) 2024-11-20 EP disclosed
US-12145945-B2 Compounds, compositions, and therapeutic uses thereof BREAKPOINT THERAPEUTICS GMBH (DE) 2024-11-19 US disclosed
US-20240336628-A1 NOVEL COMPOUNDS, COMPOSITIONS, AND THERAPEUTIC USES THEREOF BREAKPOINT THERAPEUTICS GMBH (DE) 2024-10-10 US disclosed
US-20240327431-A1 DNA POLYMERASE THETA INHIBITOR FOR TREATMENT OF CANCER BREAKPOINT THERAPEUTICS GMBH (DE) 2024-10-03 US disclosed
WO-2007105177-A1 TETRAHYDROISOQUINOLINE DERIVATIVES TO ENHANCE MEMORY FUNCTION ACTELION PHARMACEUTICALS LTD (CH) 2007-09-20 WO disclosed
WO-2006083673-A2 PYRIDINE DERIVATIVES USEFUL AS INHIBITORS OF C-JUN N-TERMINAL KINASES ABBOTT LABORATORIES (US) 2006-08-10 WO disclosed
US-20060173050-A1 Inhibitors of c-Jun N-terminal kinases ABBVIE INC. 2006-08-03 US disclosed
US-20050171132-A1 Diaminopyrimidine derivatives as selective growth hormone secrectgogue receptor (GHS-R) antagonists XIN ZHILI (US) 2005-08-04 US disclosed
US-20050171131-A1 Diaminopyrimidine derivatives as growth hormone secrectgogue receptor (GHS-R) antagonists KOSOGOF CHRISTI (US) 2005-08-04 US disclosed
WO-2005030734-A1 DIAMINOPYRIMIDINE DERIVATIVES AS SELECTIVE GROWTH HORMONE SECRECTGOGUE RECEPTOR (GHS-R) ANTAGONISTS ABBOTT LABORATORIES (US) 2005-04-07 WO disclosed
US-20050070712-A1 Pyrimidine derivatives as ghrelin receptor modulators ABBOTT LABORATORIES 2005-03-31 US disclosed
US-6225320-B1 TREATMENT OF PAIN, INFLAMMATION, MIGRAINE, EMESIS AND POSTTHERPETIC NEURALGIA MERCK SHARP & DOHME LTD. (GB) 2001-05-01 US disclosed
EP-0989987-A1 SPIRO-AZACYCLIC DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LTD. (GB) 2000-04-05 EP disclosed
WO-1998054187-A1 SPIRO-AZACYCLIC DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LIMITED (GB) 1998-12-03 WO 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 (11 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-12162895-B2 DNA polymerase theta inhibitor for treatment of cancer POLQ, POLB, POLH TRPV4 4866/4885KDM4E 2327/4885MAPT 1209/4885
US-20060173050-A1 Inhibitors of c-Jun N-terminal kinases MAPKAPK3, MAP3K3, MAPK3 TRPV4 4516/4885KDM4E 2987/4885MAPT 1136/4885
US-20250122221-A1 SIX-MEMBERED CYCLOTHIAZOLE COMPOUND AND USE THEREOF POLRMT, POLQ, POLH TRPV4 4447/4885KDM4E 2890/4885MAPT 99/4885
US-20250092016-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CORONAVIRAL RELATED DISEASES ACE2, ACE, TMPRSS2 TRPV4 4257/4885KDM4E 3570/4885MAPT 1917/4885
US-20050171131-A1 Diaminopyrimidine derivatives as growth hormone secrectgogue receptor (GHS-R) antagonists GHSR, GIPR, GPR119 TRPV4 3734/4885KDM4E 1308/4885MAPT 4601/4885
US-20240336628-A1 NOVEL COMPOUNDS, COMPOSITIONS, AND THERAPEUTIC USES THEREOF POLQ, POLK, POLB TRPV4 4776/4885KDM4E 3796/4885MAPT 1489/4885
US-20050171132-A1 Diaminopyrimidine derivatives as selective growth hormone secrectgogue receptor (GHS-R) antagonists GHSR, GIPR, GPR119 TRPV4 3721/4885KDM4E 1366/4885MAPT 4628/4885
US-20240327431-A1 DNA POLYMERASE THETA INHIBITOR FOR TREATMENT OF CANCER POLQ, POLB, POLH TRPV4 4866/4885KDM4E 2327/4885MAPT 1209/4885
US-20050070712-A1 Pyrimidine derivatives as ghrelin receptor modulators GPR119, GIPR, GCGR TRPV4 2088/4885KDM4E 1540/4885MAPT 4420/4885
US-12145945-B2 Compounds, compositions, and therapeutic uses thereof POLQ, POLK, POLB TRPV4 4835/4885KDM4E 3750/4885MAPT 1441/4885
US-12441725-B2 ISO-citrate dehydrogenase (IDH) inhibitor IDH2, IDH3A, IDH1 TRPV4 4417/4885KDM4E 573/4885MAPT 2497/4885

“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.