SCHEMBL9628202

SCHEMBL9628202

CC(CCCc1ccc(OCc2cccc(Cl)c2)cc1)N(C)C(=O)OC(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 7/20 0.54
▸ ALOX5 P09917 1/20 0.53
▸ MAOA P21397 2/20 0.48
▸ RXRA P19793 1/20 0.47
▸ RXRB P28702 1/20 0.47
▸ RXRG P48443 1/20 0.47
▸ PKM P14618 1/20 0.45
▸ S1PR1 P21453 1/20 0.45
▸ S1PR5 Q9H228 1/20 0.45
▸ FFAR1 O14842 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
SCHEMBL9628072 0.88 MAOB (0.66) MAOBALOX5MAOARXRARXRB
SCHEMBL9626593 0.79 KDM4E (0.43) —
SCHEMBL31703580 0.78 ALOX5 (0.59) MAOBALOX5MAOARXRARXRB
SCHEMBL9628030 0.78 MAOB (0.60) MAOBALOX5MAOARXRARXRB
SCHEMBL9626517 0.76 FFAR1 (0.42) MAOBALOX5PKMFFAR1
SCHEMBL9627382 0.75 MAOB (0.63) MAOBALOX5MAOARXRARXRB
SCHEMBL9626408 0.74 MAOB (0.57) MAOBALOX5MAOARXRARXRB
SCHEMBL9626343 0.73 MAOB (0.67) MAOBALOX5MAOARXRARXRB
SCHEMBL9627603 0.73 MAOB (0.56) MAOBALOX5MAOARXRARXRB
SCHEMBL31407768 0.73 CTSL (0.43) MAOBALOX5PKMFFAR1

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
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