SCHEMBL9628508

SCHEMBL9628508

OCCc1ccc(OCc2cccc(Cl)c2)cc1

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.71
RXRA P19793 1/20 0.62
RXRB P28702 1/20 0.62
RXRG P48443 1/20 0.62
MAOA P21397 2/20 0.61
ALOX5 P09917 1/20 0.59
S1PR1 P21453 1/20 0.54
S1PR5 Q9H228 1/20 0.54
CYP4F2 P78329 1/20 0.54
CYP4A11 Q02928 1/20 0.54
LTA4H P09960 1/20 0.54
EPHX2 P34913 1/20 0.54
NR4A2 P43354 1/20 0.54
DHFR P00374 1/20 0.53

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
SCHEMBL9626584 0.91 LTA4H (0.68) MAOBRXRARXRBRXRGMAOA
SCHEMBL9627104 0.90 MAOB (0.66) MAOBRXRARXRBRXRGMAOA
SCHEMBL30398136 0.87 MAOB (0.73) MAOBRXRARXRBRXRGMAOA
SCHEMBL9626627 0.87 MAOB (0.73) MAOBRXRARXRBRXRGMAOA
SCHEMBL3624161 0.83 MAOB (0.73) MAOBRXRARXRBRXRGMAOA
Hydrochloric Acid SCHEMBL7429625 0.83 MAOB (1.00) MAOBRXRARXRBRXRGMAOA
SCHEMBL1680762 0.82 MAOB (1.00) MAOBRXRARXRBRXRGMAOA
SCHEMBL966309 0.82 MAOB (0.69) MAOBMAOALTA4HEPHX2NR4A2
SCHEMBL9626424 0.81 MAOB (0.69) MAOBRXRARXRBRXRGMAOA
SCHEMBL9627382 0.81 MAOB (0.63) MAOBRXRARXRBRXRGMAOA

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