SCHEMBL6638470

SCHEMBL6638470

CC(C)(Oc1ccc(CCN(Cc2ccc(C(F)(F)F)cc2)c2noc(C3CCOC3)n2)cc1)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 19/20 0.42
PPARD Q03181 16/20 0.42
PPARG P37231 9/20 0.42

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
SCHEMBL4574698 0.92 PPARA (0.46) PPARAPPARDPPARG
SCHEMBL4576178 0.91 PPARA (0.45) PPARAPPARDPPARG
SCHEMBL4575396 0.91 PPARA (0.45) PPARAPPARDPPARG
SCHEMBL4575955 0.90 PPARA (0.44) PPARAPPARDPPARG
SCHEMBL4576147 0.90 PPARA (0.44) PPARAPPARDPPARG
SCHEMBL4576195 0.87 PPARA (0.44) PPARAPPARDPPARG
SCHEMBL4575268 0.86 PPARA (0.42) PPARAPPARDPPARG
SCHEMBL4575862 0.86 PPARA (0.41) PPARAPPARDPPARG
SCHEMBL4575594 0.85 PPARA (0.41) PPARAPPARDPPARG
SCHEMBL4575787 0.85 LMNA (0.42) PPARAPPARDPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7319104-B2 hPPARs activators SMITHKLINE BEECHAM CORPORATION (US) 2008-01-15 US disclosed
US-7319104-B2 hPPARs activators SMITHKLINE BEECHAM CORPORATION (US) 2008-01-15 US disclosed
EP-1480957-A1 HPPARS ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2004-12-01 EP disclosed
WO-2003074495-A1 HPPARS ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2003-09-12 WO disclosed