SCHEMBL8935317

SCHEMBL8935317

CC(N)C(=O)N(C)Cc1ccc(OCc2cccc(Cl)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.62
MAOB P27338 8/20 0.60
MAOA P21397 3/20 0.57
RXRA P19793 1/20 0.55
RXRB P28702 1/20 0.55
RXRG P48443 1/20 0.55
ADAMTS4 O75173 1/20 0.50
MMP13 P45452 1/20 0.50
FFAR1 O14842 1/20 0.50
PKM P14618 1/20 0.50

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
SCHEMBL8935296 0.89 ALOX5 (0.60) ALOX5MAOBMAOARXRARXRB
SCHEMBL8935263 0.85 ALOX5 (0.67) ALOX5MAOBMAOARXRARXRB
SCHEMBL2020147 0.83 MAOB (0.62) ALOX5MAOBMAOARXRARXRB
SCHEMBL2020148 0.83 MAOB (0.62) ALOX5MAOBMAOARXRARXRB
SCHEMBL8935250 0.81 MAOB (0.63) ALOX5MAOBMAOARXRARXRB
SCHEMBL2017533 0.80 ALOX5 (0.63) ALOX5MAOBMAOARXRARXRB
SCHEMBL8935297 0.80 MAOB (0.59) MAOBMAOA
SCHEMBL8935332 0.79 GID4 (0.62) ALOX5MAOBMAOARXRARXRB
SCHEMBL9131943 0.79 MAOB (0.60) ALOX5MAOBMAOARXRARXRB
SCHEMBL7396817 0.79 MAOB (0.60) ALOX5MAOBMAOARXRARXRB

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