SCHEMBL10693671

SCHEMBL10693671

Cc1nc(=O)oc2cc(C(=O)/C=C/c3ccc(Cl)cc3)ccc12

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.53
MAOA P21397 6/20 0.53
ABCG2 Q9UNQ0 1/20 0.50
CXCL12 P48061 3/20 0.48
MEN1 O00255 1/20 0.47
USP2 O75604 1/20 0.47
KMT2A Q03164 1/20 0.47
CYP1B1 Q16678 1/20 0.46

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
SCHEMBL10691949 0.89 MAPT (0.52) MAOBMAOACXCL12MEN1KMT2A
SCHEMBL10693571 0.83 TTR (0.45) MEN1KMT2A
SCHEMBL11818074 0.73 MAOB (0.69) MAOBMAOAABCG2CXCL12CYP1B1
SCHEMBL11818070 0.73 MAOB (0.69) MAOBMAOAABCG2CXCL12CYP1B1
SCHEMBL28505227 0.72 ESR1 (0.53) MAOBMAOAABCG2CXCL12CYP1B1
Hydrochloric Acid SCHEMBL11819938 0.72 MAOB (0.68) MAOBMAOAABCG2CXCL12CYP1B1
Hydrochloric Acid SCHEMBL11819942 0.72 MAOB (0.68) MAOBMAOAABCG2CXCL12CYP1B1
4',4-Dichlorochalcone SCHEMBL659210 0.72 MAOB (0.86) MAOBMAOAABCG2CXCL12CYP1B1
4',4-Dichlorochalcone SCHEMBL659211 0.72 MAOB (0.86) MAOBMAOAABCG2CXCL12CYP1B1
SCHEMBL28017674 0.71 IP6K1 (0.56) MAOBMAOAABCG2CXCL12CYP1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4778792-A Use of 7-acyl benzoxazinones and their derivatives in treating atheromatous disorders LABORATORIES NEGMA (FR) 1988-10-18 US disclosed