SCHEMBL4602803

SCHEMBL4602803

COC(=O)c1ccc(CCOc2ccc(C#N)c(C(F)(F)F)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AR P10275 12/20 0.48
MAPT P10636 1/20 0.46
PGR P06401 1/20 0.44
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RXRG P48443 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
SCHEMBL4193458 0.85 AR (0.61) ARPGR
SCHEMBL4603692 0.82 AR (0.55) AR
SCHEMBL4201441 0.81 AR (0.49) ARPGR
SCHEMBL4601213 0.80 AR (0.55) AR
SCHEMBL2473339 0.80 NOTUM (0.57) ARPGRRXRARXRBRXRG
SCHEMBL14967039 0.79 MAPT (0.62) MAPT
SCHEMBL13780061 0.78 AR (0.46) ARPGR
SCHEMBL4193337 0.78 AR (0.47) ARPGR
SCHEMBL3412694 0.78 AR (0.48) ARMAPTPGR
SCHEMBL4191279 0.76 AR (0.59) ARPGR

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-1915338-A2 ANDROGEN MODULATORS Warner-Lambert Company LLC (US) 2008-04-30 EP disclosed
WO-2007017754-A2 ANDROGEN MODULATORS WARNER-LAMBERT COMPANY LLC (US) 2007-02-15 WO disclosed