SCHEMBL13747780

SCHEMBL13747780

Cc1c(N[C@@H](C(=O)NN)[C@H](C)O)ccc(C#N)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AR P10275 9/20 0.48
PGR P06401 5/20 0.47
NR3C1 P04150 2/20 0.41
NR3C2 P08235 3/20 0.39
CXCR1 P25024 1/20 0.36
CXCR2 P25025 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL13748628 1.00 AR (0.48) ARPGRNR3C1NR3C2CXCR1
SCHEMBL15712940 0.87 AR (0.39) ARPGRNR3C1CXCR1CXCR2
SCHEMBL1291460 0.86 AR (0.51) ARPGRNR3C1NR3C2
SCHEMBL1364405 0.86 AR (0.51) ARPGRNR3C1NR3C2
SCHEMBL12342663 0.86 AR (0.51) ARPGRNR3C1NR3C2
SCHEMBL1362970 0.86 AR (0.51) ARPGRNR3C1NR3C2
SCHEMBL12342293 0.86 AR (0.51) ARPGRNR3C1NR3C2
SCHEMBL12140365 0.86 AR (0.51) ARPGRNR3C1NR3C2
SCHEMBL1364620 0.86 AR (0.47) ARPGRNR3C1NR3C2CXCR1
SCHEMBL2386549 0.86 AR (0.47) ARPGRNR3C1NR3C2CXCR1

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-2260028-B1 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH INC (US) 2014-05-07 EP disclosed
WO-2009105214-A2 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH, INC. (US) 2009-08-27 WO disclosed