SCHEMBL28901243

SCHEMBL28901243

CC(C)(C)OC(=O)NCC(=CF)COc1ccc2c(c1)CN(Cc1ccc(Cl)cc1)C2=O

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 16/20 0.46
▸ MAOA P21397 3/20 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
SCHEMBL21768177 0.88 AOC3 (0.48) AOC3MAOA
SCHEMBL30089481 0.81 MAOA (0.63) AOC3MAOA
SCHEMBL21768064 0.81 MAOA (0.63) AOC3MAOA
SCHEMBL21768067 0.81 MAOA (0.63) AOC3MAOA
SCHEMBL30089399 0.81 MAOA (0.63) AOC3MAOA
SCHEMBL21768073 0.81 MAOA (0.63) AOC3MAOA
SCHEMBL30527046 0.81 MAOA (0.66) AOC3MAOA
SCHEMBL21041147 0.81 MAOA (0.66) AOC3MAOA
SCHEMBL21042113 0.81 MAOA (0.66) AOC3MAOA
SCHEMBL28901240 0.80 GAA (0.36) —

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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