SCHEMBL15468237

SCHEMBL15468237

CS(=O)(=O)NC(=O)CCCc1ccc(N2C(=O)N(c3ccc(C#N)c(C(F)(F)F)c3)C(=O)C23CCC3)cc1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AR P10275 18/20 0.54
NR3C1 P04150 1/20 0.46
HDAC1 Q13547 4/20 0.45

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
SCHEMBL20003451 0.93 AR (0.52) ARNR3C1HDAC1
SCHEMBL29508773 0.93 AR (0.64) ARNR3C1HDAC1
SCHEMBL1715961 0.93 AR (0.64) ARNR3C1HDAC1
SCHEMBL1715989 0.91 AR (0.65) ARNR3C1HDAC1
SCHEMBL30184886 0.91 AR (0.65) ARNR3C1HDAC1
SCHEMBL547082 0.83 AR (0.76) ARNR3C1HDAC1
SCHEMBL30184873 0.83 AR (0.76) ARNR3C1HDAC1
SCHEMBL19880027 0.83 AR (0.63) ARNR3C1HDAC1
SCHEMBL13237811 0.81 AR (0.58) AR
SCHEMBL2633035 0.80 AR (0.63) ARNR3C1HDAC1

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-8648105-B2 Diarylthiohydantoin compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-02-11 US disclosed