SCHEMBL9628072

SCHEMBL9628072

CC(Cc1ccc(OCc2cccc(Cl)c2)cc1)N(C)C(=O)OC(C)(C)C

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 14/20 0.66
▸ ALOX5 P09917 1/20 0.56
▸ MAOA P21397 2/20 0.52
▸ RXRA P19793 1/20 0.50
▸ RXRB P28702 1/20 0.50
▸ RXRG P48443 1/20 0.50
▸ PKM P14618 1/20 0.48

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
SCHEMBL9628202 0.88 MAOB (0.54) MAOBALOX5MAOARXRARXRB
SCHEMBL31703580 0.81 ALOX5 (0.59) MAOBALOX5MAOARXRARXRB
SCHEMBL9627307 0.81 MAOB (0.71) MAOBALOX5MAOARXRARXRB
SCHEMBL9627603 0.80 MAOB (0.56) MAOBALOX5MAOARXRARXRB
SCHEMBL16552346 0.80 MAOB (1.00) MAOBALOX5MAOA
SCHEMBL12050814 0.78 BCHE (0.53) MAOB
SCHEMBL16552398 0.78 MAOB (0.73) MAOBALOX5MAOA
SCHEMBL11659351 0.76 GPR34 (0.61) MAOBMAOARXRARXRBRXRG
SCHEMBL16634946 0.75 ITGB3 (0.55) MAOBALOX5
SCHEMBL29397771 0.75 ITGB3 (0.55) MAOBALOX5

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
Send feedback