SCHEMBL8935296

SCHEMBL8935296

CN(Cc1ccc(OCc2cccc(Cl)c2)cc1)C(=O)C(N)CO

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.60
MAOB P27338 8/20 0.55
MAOA P21397 3/20 0.55
RXRA P19793 1/20 0.53
RXRB P28702 1/20 0.53
RXRG P48443 1/20 0.53
FFAR1 O14842 1/20 0.48
PKM P14618 1/20 0.48
S1PR1 P21453 1/20 0.47
S1PR5 Q9H228 1/20 0.47

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
SCHEMBL8935317 0.89 ALOX5 (0.62) ALOX5MAOBMAOARXRARXRB
SCHEMBL8935251 0.87 MAOB (0.58) MAOBMAOA
SCHEMBL8935376 0.84 MAOB (0.60) MAOBFFAR1S1PR1S1PR5
SCHEMBL8935263 0.83 ALOX5 (0.67) ALOX5MAOBMAOARXRARXRB
SCHEMBL8935250 0.82 MAOB (0.63) ALOX5MAOBMAOARXRARXRB
SCHEMBL8935286 0.81 MAOB (0.54) MAOBMAOA
SCHEMBL8935439 0.79 GID4 (0.61) ALOX5MAOBMAOARXRARXRB
SCHEMBL2020147 0.79 MAOB (0.62) ALOX5MAOBMAOARXRARXRB
SCHEMBL2020148 0.79 MAOB (0.62) ALOX5MAOBMAOARXRARXRB
SCHEMBL8935232 0.78 FFAR1 (0.51) FFAR1

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
US-5502079-A TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS FARMITALIA CARLO ERBA S.R.L. (IT) 1996-03-26 US disclosed