SCHEMBL3659657

SCHEMBL3659657

CC1(C)C(=O)N(c2ccc(C#N)c(C3CC3)c2)C(=O)N1Cc1ccc(F)cc1NC(=O)Nc1ccc([S])cc1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AR P10275 6/20 0.40
CNR1 P21554 1/20 0.39
PGR P06401 1/20 0.38
HDAC1 Q13547 1/20 0.37

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
SCHEMBL6524805 0.92 CNR1 (0.39) ARCNR1PGR
SCHEMBL1974760 0.92 CNR1 (0.43) ARCNR1PGR
SCHEMBL6519999 0.92 CNR1 (0.43) ARCNR1PGR
SCHEMBL6521558 0.91 CNR1 (0.42) ARCNR1PGR
SCHEMBL1975686 0.91 CNR1 (0.42) ARCNR1PGRHDAC1
SCHEMBL1973173 0.91 CNR1 (0.50) ARCNR1
SCHEMBL6523498 0.90 AR (0.37) ARCNR1PGR
SCHEMBL1973862 0.89 CNR1 (0.41) ARCNR1PGR
SCHEMBL8021094 0.88 CNR1 (0.40) ARCNR1PGRHDAC1
SCHEMBL3523761 0.84 AR (0.40) ARPGRHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2252591-A1 ARYL-SUBSTITUTED IMIDAZOLIDINE-2,4-DIONES, METHOD FOR THE PRODUCTION THEREOF, MEDICAMENTS CONTAINING SAID COMPOUNDS AND USE THEREOF Sanofi-Aventis (FR) 2010-11-24 EP disclosed
WO-2009097999-A1 ARYL-SUBSTITUTED IMIDAZOLIDINE-2,4-DIONES, METHOD FOR THE PRODUCTION THEREOF, MEDICAMENTS CONTAINING SAID COMPOUNDS AND USE THEREOF SANOFI-AVENTIS (FR) 2009-08-13 WO disclosed