SCHEMBL10693667

SCHEMBL10693667

CC1C(=O)NOc2cc(C(=O)C=Cc3ccc(Cl)cc3)ccc21

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.53
MAOA P21397 4/20 0.53
ABCG2 Q9UNQ0 1/20 0.48
RELA Q04206 1/20 0.46
CXCL12 P48061 3/20 0.46
CYP1B1 Q16678 1/20 0.44
STAT3 P40763 1/20 0.43
DHODH Q02127 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
SCHEMBL10691942 0.90 XDH (0.49) MAOBMAOAABCG2RELACXCL12
SCHEMBL10696023 0.89 MAPT (0.51) MAOBMAOACYP1B1STAT3
SCHEMBL10691543 0.80 MAOB (0.53) MAOBMAOAABCG2RELACXCL12
SCHEMBL10693989 0.79 MAOB (0.52) MAOBMAOAABCG2RELACXCL12
4',4-Dichlorochalcone SCHEMBL659210 0.70 MAOB (0.86) MAOBMAOAABCG2CXCL12CYP1B1
4',4-Dichlorochalcone SCHEMBL659211 0.70 MAOB (0.86) MAOBMAOAABCG2CXCL12CYP1B1
SCHEMBL10694710 0.70 XDH (0.49) MAOBMAOARELACXCL12CYP1B1
SCHEMBL10693327 0.70 XDH (0.49) MAOBMAOARELACXCL12CYP1B1
SCHEMBL16052573 0.70 MAOB (0.85) MAOBMAOACXCL12STAT3
SCHEMBL16052572 0.70 MAOB (0.85) MAOBMAOACXCL12STAT3

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