SCHEMBL30089481

SCHEMBL30089481

NC/C(=C/F)COc1ccc2c(c1)CN(Cc1ccc(Cl)cc1)C2=O

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 4/20 0.63
▸ AOC3 Q16853 16/20 0.59
▸ MAOB P27338 1/20 0.56

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
SCHEMBL21768067 1.00 MAOA (0.63) MAOAAOC3MAOB
SCHEMBL21768064 1.00 MAOA (0.63) MAOAAOC3MAOB
SCHEMBL21768073 1.00 MAOA (0.63) MAOAAOC3MAOB
SCHEMBL30089399 1.00 MAOA (0.63) MAOAAOC3MAOB
SCHEMBL21768177 0.86 AOC3 (0.48) MAOAAOC3
SCHEMBL21780109 0.85 ITGB3 (0.44) MAOAAOC3MAOB
SCHEMBL28901243 0.81 AOC3 (0.46) MAOAAOC3
SCHEMBL21040302 0.80 AOC3 (0.81) MAOAAOC3MAOB
SCHEMBL21040809 0.77 MAOA (0.67) MAOAAOC3MAOB
SCHEMBL22462073 0.77 MAOA (1.00) MAOAAOC3MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110352188-B Fluoroallylamine derivatives and use thereof 四川科伦博泰生物医药股份有限公司 2022-11-29 — — CN disclosed
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