SCHEMBL4070376

SCHEMBL4070376

Cc1ncccc1Oc1ccc(N)cn1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.63
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
MAP4K4 O95819 1/20 0.53
KDM4E B2RXH2 5/20 0.49
ALDH1A1 P00352 1/20 0.48
BRCA1 P38398 1/20 0.48
HBB P68871 1/20 0.48
HSD17B10 Q99714 1/20 0.48
HTR2C P28335 11/20 0.46
POLB P06746 2/20 0.46
RAB9A P51151 1/20 0.45
ADORA2A P29274 1/20 0.45
ADORA1 P30542 1/20 0.45
HTR2B P41595 1/20 0.44

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
SCHEMBL4234667 0.81 KMT2A (0.58) KEAP1MEN1KMT2AMAP4K4KDM4E
SCHEMBL4230135 0.81 KMT2A (0.58) KEAP1MEN1KMT2AMAP4K4KDM4E
SCHEMBL4064464 0.80 KEAP1 (0.77) KEAP1MEN1KMT2AMAP4K4KDM4E
SCHEMBL14874767 0.79 HTR2C (0.53) HTR2CHTR2B
SCHEMBL13661726 0.78 HTR2C (0.46) MAP4K4HTR2CHTR2B
SCHEMBL13657732 0.78 HTR2C (0.46) KMT2AMAP4K4KDM4EHTR2CPOLB
SCHEMBL4796326 0.78 MEN1 (0.56) MEN1KMT2AMAP4K4ALDH1A1POLB
SCHEMBL10271917 0.77 KEAP1 (0.59) KEAP1MEN1KMT2AKDM4EALDH1A1
SCHEMBL1014038 0.77 KEAP1 (1.00) KEAP1MEN1KMT2AKDM4EALDH1A1
SCHEMBL23720003 0.77 MEN1 (0.66) KEAP1MEN1KMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2108649-B1 Novel indol carboxylic acid bispyridyl carboxamide derivatives as 5-HT2c receptor antagonists KOREA RES INST CHEM TECH (KR) 2013-04-24 EP claimed
EP-1028945-B9 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC (US) 2009-02-18 EP disclosed
US-7291738-B2 Therapeutic compounds PHARMACIA & UPJOHN COMPANY (US) 2007-11-06 US disclosed
EP-1028945-B1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC (US) 2007-07-11 EP disclosed
US-6861420-B2 N-substituted 1,2,4,5-tetrahydro-1H-benzo[d]azepine compounds PHARMACIA & UPJOHN COMPANY (US) 2005-03-01 US disclosed
EP-1485386-A2 PYRIDINYLOXY DERIVATIVES AS 5-HT RECEPTOR LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2004-12-15 EP disclosed
EP-1451176-A2 BENZAZEPINE DERIVATIVES AND THEIR USE AS 5-HT LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2004-09-01 EP disclosed
EP-1146044-B1 CNS active cyclobuta-indole carboxamide derivatives, processes for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2004-09-01 EP disclosed
US-6743818-B2 TREATING ANXIETY, PANIC ATTACKS, OBSESSIVE-COMPULSIVE DISORDERS, PHOBIAS, IMPULSIVE DISORDERS, DRUG ABUSE, COGNITIVE DISORDERS, PSYCHOSES, DEPRESSION AND MOOD DISORDERS LES LABORATOIRES SERVIER (FR) 2004-06-01 US disclosed
US-20040087798-A1 Novel amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 US disclosed
US-6184237-B1 Substituted pyridine compounds and methods of use AMGEN INC. 2001-02-06 US disclosed
EP-0808312-B1 INDOLE DERIVATIVES AS 5-HT RECEPTOR ANTAGONIST SMITHKLINE BEECHAM PLC (GB) 2000-11-02 EP disclosed
EP-1028945-A1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS Amgen Inc. (US) 2000-08-23 EP disclosed
US-5990133-A TREATING CENTRAL NERVOUS SYSTEM DISORDERS SUCH AS ANXIETY OR DEPRESSION SMITHKLINE BEECHAM P.L.C. (GB) 1999-11-23 US disclosed
WO-1999043650-A2 PROCESS(ES) FOR THE PREPARATION OF 6-TRIFLUOROMETHYL-INDOLINE DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 1999-09-02 WO disclosed
WO-1999024404-A1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC. (US) 1999-05-20 WO disclosed
EP-0912554-A1 INDOLINE DERIVATIVES USEFUL AS 5-HT-2C RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1999-05-06 EP disclosed
WO-1997048699-A1 INDOLINE DERIVATIVES USEFUL AS 5-HT-2C RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1997-12-24 WO disclosed
EP-0808312-A1 INDOLE DERIVATIVES AS 5-HT RECEPTOR ANTAGONIST SMITHKLINE BEECHAM PLC (GB) 1997-11-26 EP disclosed
WO-1996023783-A1 INDOLE DERIVATIVES AS 5-HT RECEPTOR ANTAGONIST SMITHKLINE BEECHAM PLC (GB) 1996-08-08 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 (1 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-20040087798-A1 Novel amide compounds H1-2, H1-0, H1-3 KEAP1 2808/4885MEN1 970/4885KMT2A 130/4885

“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.