SCHEMBL4682146

SCHEMBL4682146

CCCN(Cc1ccc(OC(C)(C)C(=O)OCC)c(C)c1)Cc1cc(-c2ccc(C(F)(F)F)cc2)nn1C

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 18/20 0.45
PPARG P37231 15/20 0.45
PPARD Q03181 14/20 0.45
AGER Q15109 1/20 0.37
FBP1 P09467 1/20 0.35

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
SCHEMBL14445990 0.92 PPARA (0.53) PPARAPPARGPPARD
SCHEMBL14445956 0.90 PPARA (0.46) PPARAPPARGPPARDFBP1
SCHEMBL14445963 0.83 PPARG (0.38) PPARAPPARGPPARDAGERFBP1
SCHEMBL14445976 0.82 PPARA (0.41) PPARAPPARGPPARDFBP1
SCHEMBL14445985 0.80 PPARA (0.56) PPARAPPARGPPARD
SCHEMBL4678572 0.80 PPARA (0.42) PPARAPPARGPPARD
SCHEMBL5407750 0.79 PPARD (0.39) PPARAPPARGPPARDAGERFBP1
SCHEMBL4682719 0.79 PPARA (0.42) PPARAPPARGPPARD
SCHEMBL4742857 0.78 MAPT (0.42) PPARAPPARGPPARD
SCHEMBL4682143 0.78 PPARD (0.41) PPARAPPARGPPARDAGERFBP1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US claimed
EP-1513796-B1 PHENYLOXYALKANOIC ACID DERIVATIVES AS HPPAR ACTIVATORS SMITHKLINE BEECHAM CORP (US) 2008-02-13 EP disclosed
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US disclosed
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US disclosed
US-7241793-B2 Phenyloxyalkanonic acid derivatives as hPPAR activators SMITHKLINE BEECHAM CORPORATION (US) 2007-07-10 US disclosed