SCHEMBL3454540

SCHEMBL3454540

Cc1nc(-c2cc(C(F)(F)F)c[nH]c2=O)sc1C(=O)NCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCD O00767 8/20 0.57
PPARA Q07869 10/20 0.54
PPARD Q03181 3/20 0.54
PPARG P37231 3/20 0.51

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
SCHEMBL3454783 0.85 SCD (0.56) SCDPPARAPPARD
SCHEMBL3455616 0.82 SCD (0.57) SCDPPARAPPARD
SCHEMBL3455558 0.82 PPARA (0.55) SCDPPARAPPARDPPARG
SCHEMBL3455677 0.81 SCD (0.60) SCDPPARAPPARD
SCHEMBL3454303 0.79 SCD (0.61) SCD
SCHEMBL3454189 0.78 PPARA (0.55) SCDPPARAPPARDPPARG
SCHEMBL3454098 0.77 SCD (0.58) SCDPPARAPPARD
SCHEMBL3456450 0.76 SCD (0.55) SCDPPARAPPARD
SCHEMBL3454226 0.75 PPARA (0.53) SCDPPARAPPARDPPARG
SCHEMBL3454343 0.75 PPARA (0.54) SCDPPARAPPARD

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
WO-2007143597-A9 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-11-11 WO claimed