SCHEMBL8539561

SCHEMBL8539561

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

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
PARP1 P09874 1/20 0.40
GPR84 Q9NQS5 5/20 0.39
GSK3B P49841 1/20 0.38
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL8540485 0.89 PARP1 (0.41) MAPTHTTPARP1GPR84GSK3B
SCHEMBL9373258 0.86 PARP1 (0.43) MAPTHTTPARP1GPR84GSK3B
SCHEMBL8542673 0.86 PARP1 (0.39) MAPTHTTPARP1GPR84GSK3B
SCHEMBL8544096 0.85 PARP1 (0.46) MAPTHTTPARP1GPR84GSK3B
SCHEMBL9423818 0.85 PARP1 (0.38) MAPTHTTPARP1GPR84GSK3B
SCHEMBL9432726 0.84 PARP1 (0.41) MAPTHTTPARP1GPR84GSK3B
SCHEMBL9052175 0.82 MAPT (0.59) MAPTHTTPARP1GSK3BTSHR
SCHEMBL9310425 0.81 PARP1 (0.38) MAPTHTTPARP1GPR84GSK3B
SCHEMBL9310820 0.79 SMN1; SMN2 (0.32) MAPTHTTPARP1GPR84GSK3B
SCHEMBL8540141 0.79 PARP1 (0.43) MAPTHTTPARP1GPR84GSK3B

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 12 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
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
US-5284853-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