SCHEMBL9627112

SCHEMBL9627112

CNC(C)COc1ccc(OCc2cccc(Cl)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 6/20 0.58
▸ MAOA P21397 2/20 0.56
▸ ALOX5 P09917 1/20 0.54
▸ RXRA P19793 1/20 0.53
▸ RXRB P28702 1/20 0.53
▸ RXRG P48443 1/20 0.53
▸ DHFR P00374 1/20 0.49
▸ ADAMTS4 O75173 1/20 0.48
▸ MMP13 P45452 1/20 0.48
▸ SLC2A1 P11166 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
SCHEMBL9628042 0.88 MAOB (0.61) MAOBMAOAALOX5RXRARXRB
SCHEMBL9626522 0.85 MAOB (0.60) MAOBMAOAALOX5RXRARXRB
SCHEMBL9627722 0.83 MAOB (0.58) MAOBMAOAALOX5RXRARXRB
SCHEMBL9626408 0.83 MAOB (0.57) MAOBMAOAALOX5RXRARXRB
SCHEMBL19513578 0.82 HTR1D (0.57) —
SCHEMBL19513368 0.82 HTR1D (0.57) —
SCHEMBL21234325 0.81 MAOB (0.67) MAOBMAOAALOX5RXRARXRB
SCHEMBL22874579 0.80 MAOB (0.65) MAOBMAOAALOX5RXRARXRB
SCHEMBL22874580 0.79 MAOB (0.60) MAOBMAOAALOX5RXRARXRB
SCHEMBL7090303 0.78 SCN4A (0.46) MAOA

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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