SCHEMBL8545112

SCHEMBL8545112

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
ATM Q13315 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
KDM4E B2RXH2 5/20 0.50
ALDH1A1 P00352 4/20 0.50
HSD17B10 Q99714 4/20 0.50
HPGD P15428 3/20 0.50
GAA P10253 2/20 0.49
MAPT P10636 1/20 0.49
PKM P14618 1/20 0.49
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
KIF11 P52732 2/20 0.44
MAPK1 P28482 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ALOX12 P18054 1/20 0.43
MDH2 P40926 2/20 0.43
ALOX15 P16050 1/20 0.43
CASP1 P29466 1/20 0.43

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
SCHEMBL8541623 0.86 KIF11 (0.43) MEN1KMT2AATML3MBTL1MAPT
SCHEMBL8632161 0.84 MAPT (0.55) MEN1KMT2AATML3MBTL1ALDH1A1
SCHEMBL9165501 0.83 PARP1 (0.41) KDM4EALDH1A1HSD17B10HPGDMAPT
SCHEMBL8632170 0.81 MAPT (0.64) KMT2AL3MBTL1KDM4EALDH1A1GAA
SCHEMBL9169051 0.80 ALDH1A1 (0.47) MEN1KMT2AL3MBTL1KDM4EALDH1A1
SCHEMBL9164367 0.80 KDM4E (0.45) KDM4EALDH1A1MAPTNPC1RAB9A
SCHEMBL7338067 0.80 MAPT (0.53) MEN1KMT2AATML3MBTL1GAA
SCHEMBL9052175 0.78 MAPT (0.59) MEN1KMT2AKDM4EALDH1A1HSD17B10
SCHEMBL8540141 0.78 PARP1 (0.43) MAPTGSK3B
SCHEMBL8538920 0.77 PARP1 (0.45) MAPTGSK3B

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 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
EP-0621276-A1 Angiotensin II receptor blocking 2,3,6-substituted quinazolinones AMERICAN CYANAMID COMPANY (US) 1994-10-26 EP 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-5286729-A Therapy for congestive heart failure AMERICAN CYANAMID COMPANY (US) 1994-02-15 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