SCHEMBL5489981

SCHEMBL5489981

C=CCN1c2ccc3nc(OC(C)C)cc(C(F)(F)F)c3c2OCC1CC

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AR P10275 20/20 0.58
NR3C1 P04150 3/20 0.45
PGR P06401 2/20 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
SCHEMBL5125307 1.00 AR (0.58) ARNR3C1PGR
SCHEMBL5123747 0.90 AR (0.57) ARNR3C1PGR
SCHEMBL5123735 0.90 AR (0.57) ARNR3C1PGR
SCHEMBL5125424 0.90 AR (0.55) ARNR3C1PGR
SCHEMBL5128999 0.90 AR (0.61) ARNR3C1PGR
SCHEMBL5124234 0.89 AR (0.57) ARNR3C1PGR
SCHEMBL5129186 0.88 AR (0.56) ARNR3C1PGR
SCHEMBL5119368 0.88 AR (0.59) ARNR3C1PGR
SCHEMBL5489173 0.88 AR (0.59) ARNR3C1PGR
SCHEMBL5124380 0.88 AR (0.52) ARNR3C1PGR

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-7214690-B2 Tricyclic quinolinone and tricyclic quinoline androgen receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2007-05-08 US disclosed