SCHEMBL14440682

SCHEMBL14440682

Cc1c(N2C(=O)[C@H](CO)N(C)C2=O)ccc(C#N)c1Cl

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AR P10275 16/20 0.55
CYP2C19 P33261 1/20 0.44

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
SCHEMBL5642938 1.00 AR (0.55) ARCYP2C19
SCHEMBL14440688 0.88 AR (0.53) ARCYP2C19
SCHEMBL5642371 0.88 AR (0.53) ARCYP2C19
SCHEMBL5640316 0.86 AR (0.49) ARCYP2C19
SCHEMBL14440681 0.86 AR (0.49) ARCYP2C19
SCHEMBL5641112 0.86 AR (0.56) ARCYP2C19
SCHEMBL14440689 0.86 AR (0.56) ARCYP2C19
SCHEMBL14440685 0.82 AR (0.50) ARCYP2C19
SCHEMBL5641533 0.82 AR (0.50) ARCYP2C19
SCHEMBL14440692 0.82 AR (0.46) ARCYP2C19

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
US-7256208-B2 Monocyclic N-Aryl hydantoin modulators of androgen receptor function BRISTOL-MYERS SQUIBB COMPANY (US) 2007-08-14 US disclosed
US-7256208-B2 Monocyclic N-Aryl hydantoin modulators of androgen receptor function BRISTOL-MYERS SQUIBB COMPANY (US) 2007-08-14 US disclosed