SCHEMBL3721639

SCHEMBL3721639

CC(C)(C)OC(=O)ON1CCN=C1c1ccc(Nc2cc(F)ccc2CN2C(=O)N(c3ccc(F)c(C(F)(F)F)c3)C(=O)C2(C)C)cc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AR P10275 12/20 0.42
CNR1 P21554 1/20 0.38
IGF1R P08069 1/20 0.34
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33

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
SCHEMBL1208129 0.90 AR (0.43) ARCNR1IGF1RHDAC3HDAC4
SCHEMBL3726848 0.84 AR (0.43) ARCNR1IGF1R
SCHEMBL3535057 0.83 AR (0.50) ARCNR1IGF1RHDAC1
SCHEMBL3669673 0.82 AR (0.42) ARCNR1IGF1R
SCHEMBL1207342 0.80 AR (0.44) ARCNR1IGF1RHDAC1
SCHEMBL3526165 0.79 AR (0.52) ARCNR1HDAC1
SCHEMBL1207994 0.79 AR (0.42) ARCNR1IGF1R
SCHEMBL3527116 0.79 AR (0.54) ARCNR1HDAC1
SCHEMBL1208780 0.79 AR (0.46) ARCNR1IGF1RHDAC1
SCHEMBL1208076 0.79 AR (0.43) ARCNR1

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-2242746-A1 HETEROCYCLICALLY-SUBSTITUTED IMIDAZOLIDINE-2,4-DIONES, METHOD FOR THE PRODUCTION THEREOF, MEDICAMENTS CONTAINING SAID COMPOUNDS AND USE THEREOF Sanofi-Aventis (FR) 2010-10-27 EP disclosed
WO-2009098000-A1 HETEROCYCLICALLY-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