SCHEMBL9626307

SCHEMBL9626307

CC(c1ccc(OCc2cccc(Cl)c2)cc1)N(C)C

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.58
ALOX5 P09917 1/20 0.57
MAOA P21397 5/20 0.56
FFAR1 O14842 1/20 0.54
RXRA P19793 1/20 0.53
RXRB P28702 1/20 0.53
RXRG P48443 1/20 0.53
MRGPRX4 Q96LA9 1/20 0.50
DHFR P00374 1/20 0.49

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
SCHEMBL21234325 0.87 MAOB (0.67) MAOBALOX5MAOAFFAR1RXRA
SCHEMBL9626322 0.86 ALOX5 (0.55) MAOBALOX5MAOAFFAR1RXRA
SCHEMBL9626469 0.83 MAOB (0.66) MAOBALOX5MAOAFFAR1RXRA
SCHEMBL9628030 0.83 MAOB (0.60) MAOBALOX5MAOARXRARXRB
SCHEMBL9627307 0.82 MAOB (0.71) MAOBALOX5MAOARXRARXRB
SCHEMBL9627722 0.81 MAOB (0.58) MAOBALOX5MAOAFFAR1RXRA
SCHEMBL9626742 0.78 MAOB (0.56) MAOBALOX5MAOAFFAR1RXRA
SCHEMBL10169470 0.77 MAOB (0.71) MAOBALOX5MAOARXRARXRB
SCHEMBL11212089 0.77 MAOB (0.70) MAOBALOX5MAOARXRARXRB
SCHEMBL18745392 0.77 MAOB (0.54) MAOBMAOAFFAR1RXRARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0477184-A1 INHIBITORS OF MONO-AMINE OXIDASE, PROCESS FOR THEIR PREPARATION, AND THEIR USE IN THERAPEUTICS. FOURNIER INDUSTRIE ET SANTE (FR) 1992-04-01 EP disclosed
WO-1990011997-A2 INHIBITORS OF MONO-AMINE OXIDASE, PROCESS FOR THEIR PREPARATION, AND THEIR USE IN THERAPEUTICS. FOURNIER INNOVATION ET SYNERGIE (FR) 1990-10-18 WO disclosed