SCHEMBL8540485

SCHEMBL8540485

CCCCc1nc(=O)c2cc(C(C)O)ccc2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.41
GPR84 Q9NQS5 5/20 0.40
GSK3B P49841 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
KDM4E B2RXH2 1/20 0.36
PIKFYVE Q9Y2I7 1/20 0.36

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
SCHEMBL9373258 0.90 PARP1 (0.43) PARP1GPR84GSK3BMAPTHTT
SCHEMBL8539561 0.89 MAPT (0.40) PARP1GPR84GSK3BMAPTHTT
SCHEMBL9432726 0.88 PARP1 (0.41) PARP1GPR84GSK3BMAPTHTT
SCHEMBL8542673 0.87 PARP1 (0.39) PARP1GPR84GSK3BMAPTHTT
SCHEMBL8544096 0.86 PARP1 (0.46) PARP1GPR84GSK3BMAPTHTT
SCHEMBL9423818 0.86 PARP1 (0.38) PARP1GPR84GSK3BMAPTHTT
SCHEMBL9310425 0.82 PARP1 (0.38) PARP1GPR84GSK3BMAPTHTT
SCHEMBL9161570 0.82 KDM4E (0.42) GSK3BMAPTHTTKDM4E
SCHEMBL9052175 0.80 MAPT (0.59) PARP1GSK3BMAPTHTTKDM4E
SCHEMBL8540141 0.80 PARP1 (0.43) PARP1GPR84GSK3BMAPTHTT

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0497150-B1 Angiotensin II receptor blocking 2,3,6-substituted quinazolones AMERICAN CYANAMID CO (US) 1998-03-18 EP claimed
CN-1066847-A Angiotensin-ii receptor blockers 2,3,6 quinazolinones that replace AMERICAN CYANAMID CO (US) 1992-12-09 CN claimed
EP-0497150-A1 Angiotensin II receptor blocking 2,3,6-substituted quinazolones AMERICAN CYANAMID COMPANY (US) 1992-08-05 EP claimed
EP-0497150-B1 Angiotensin II receptor blocking 2,3,6-substituted quinazolones AMERICAN CYANAMID CO (US) 1998-03-18 EP disclosed
CN-1037440-C Angiotensin II Receptor blocking 2,3,6 substituted quinazolinones AMERICAL CYANAMID CO (US) 1998-02-18 CN disclosed
US-5405849-A Treating hypertension, congestive heart failure AMERICAN CYANAMID COMPANY (US) 1995-04-11 US disclosed
US-5358951-A Treating hypertension, congestive heart failure AMERICAN CYANAMID COMPANY (US) 1994-10-25 US disclosed
US-5294611-A Hypotensive, congestive heart failure AMERICAN CYANAMID COMPANY (US) 1994-03-15 US disclosed
US-5292734-A Angiotensin II receptor blocking 2,3,6 substituted quinazolinones AMERICAN CYANAMID COMPANY (US) 1994-03-08 US disclosed
US-5290780-A Hypotensive agents; congestive heart failure AMERICAN CYANAMID CO. (US) 1994-03-01 US disclosed
US-5288720-A Hypotensive agents AMERICAN CYANAMID COMPANY (US) 1994-02-22 US disclosed
US-5284852-A Hypotensive agents AMERICAN CYANAMID COMPANY (US) 1994-02-08 US disclosed
CN-1066847-A Angiotensin-ii receptor blockers 2,3,6 quinazolinones that replace AMERICAN CYANAMID CO (US) 1992-12-09 CN disclosed
EP-0497150-A1 Angiotensin II receptor blocking 2,3,6-substituted quinazolones AMERICAN CYANAMID COMPANY (US) 1992-08-05 EP disclosed