SCHEMBL5704451

SCHEMBL5704451

CCc1cc(Oc2cc(F)cc(CCNC(=O)c3ccc(C(F)(F)F)cc3C)c2)ccc1CCC(=O)O

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 18/20 0.62
PPARG P37231 17/20 0.62
PPARD Q03181 16/20 0.62
ESRRB O95718 1/20 0.39
ESRRG P62508 1/20 0.39

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
SCHEMBL5704460 0.93 PPARA (0.54) PPARAPPARGPPARDESRRG
SCHEMBL5704473 0.93 PPARG (0.71) PPARAPPARGPPARD
SCHEMBL5704444 0.93 PPARA (0.53) PPARAPPARGPPARDESRRG
SCHEMBL4616672 0.92 PPARA (0.70) PPARAPPARGPPARD
SCHEMBL5704472 0.92 PPARG (0.63) PPARAPPARGPPARDESRRBESRRG
SCHEMBL5704416 0.92 PPARG (0.52) PPARAPPARGPPARDESRRBESRRG
SCHEMBL5704443 0.91 PPARA (0.51) PPARAPPARGPPARDESRRBESRRG
SCHEMBL5704415 0.87 PPARG (0.62) PPARAPPARGPPARD
SCHEMBL5704456 0.86 PPARA (0.62) PPARAPPARGPPARD
SCHEMBL5704475 0.86 PPARG (0.61) PPARAPPARGPPARDESRRBESRRG

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-1697304-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2006-09-06 EP disclosed
WO-2005054176-A1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2005-06-16 WO disclosed