SCHEMBL4489988

SCHEMBL4489988

CCC[C@@H](Oc1ccc(C#N)c(C(F)(F)F)c1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.52
PPARA Q07869 3/20 0.52
AR P10275 17/20 0.51
PGR P06401 1/20 0.46

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
SCHEMBL4140884 1.00 PPARG (0.52) PPARGPPARAARPGR
SCHEMBL4133079 1.00 PPARG (0.52) PPARGPPARAARPGR
SCHEMBL4146145 0.86 AR (0.48) ARPGR
SCHEMBL4135570 0.85 AR (0.49) PPARGPPARAARPGR
SCHEMBL4142409 0.85 AR (0.49) PPARGPPARAARPGR
SCHEMBL4133498 0.83 AR (0.47) PPARGPPARAARPGR
SCHEMBL4132662 0.83 AR (0.47) PPARGPPARAARPGR
SCHEMBL13772582 0.82 UBE2M (0.48) PPARGPPARAARPGR
SCHEMBL6549329 0.82 PPARG (0.57) PPARGPPARA
Hydrochloric Acid SCHEMBL6547951 0.81 PPARG (0.56) PPARGPPARA

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-7507860-B2 Androgen modulators PFIZER INC. (US) 2009-03-24 US claimed