SCHEMBL8935263

SCHEMBL8935263

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

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.67
MAOB P27338 7/20 0.61
AOC3 Q16853 3/20 0.59
MAOA P21397 3/20 0.58
RXRA P19793 1/20 0.56
RXRB P28702 1/20 0.56
RXRG P48443 1/20 0.56
PKM P14618 1/20 0.51
FFAR1 O14842 1/20 0.51

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 0.85 ALOX5 (0.62) ALOX5MAOBMAOARXRARXRB
SCHEMBL8935296 0.83 ALOX5 (0.60) ALOX5MAOBMAOARXRARXRB
SCHEMBL2017533 0.81 ALOX5 (0.63) ALOX5MAOBMAOARXRARXRB
SCHEMBL2020148 0.79 MAOB (0.62) ALOX5MAOBMAOARXRARXRB
SCHEMBL2020147 0.79 MAOB (0.62) ALOX5MAOBMAOARXRARXRB
SCHEMBL3970467 0.79 ALOX5 (0.61) ALOX5MAOBMAOARXRARXRB
SCHEMBL11364330 0.78 AOC3 (0.77) AOC3
SCHEMBL1680762 0.77 MAOB (1.00) ALOX5MAOBMAOARXRARXRB
SCHEMBL8935243 0.77 GID4 (0.74) ALOX5MAOBMAOARXRARXRB
SCHEMBL8935398 0.76 RAB9A (0.60) ALOX5FFAR1

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