SCHEMBL5220366

SCHEMBL5220366

Cc1cc(O[C@H](C)c2sc(-c3ccc(C(F)(F)F)cc3)nc2C)ccc1CCC(=O)O.Cc1cc(S[C@H](C)c2sc(-c3ccc(C(F)(F)F)cc3)nc2CSc2ccccc2)ccc1OCC(=O)O

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 20/20 0.60
PPARA Q07869 6/20 0.57
PPARG P37231 1/20 0.54

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
SCHEMBL5217504 0.87 PPARD (0.67) PPARDPPARAPPARG
SCHEMBL5215455 0.87 PPARD (0.67) PPARDPPARAPPARG
SCHEMBL5215461 0.87 PPARD (0.67) PPARDPPARAPPARG
SCHEMBL5215304 0.83 PPARD (0.60) PPARDPPARAPPARG
SCHEMBL6613655 0.81 PPARD (0.62) PPARDPPARAPPARG
SCHEMBL5216218 0.80 PPARD (0.70) PPARDPPARAPPARG
SCHEMBL5215930 0.80 PPARD (0.70) PPARDPPARAPPARG
SCHEMBL4830456 0.80 PPARD (0.71) PPARDPPARAPPARG
SCHEMBL5215936 0.80 PPARD (0.70) PPARDPPARAPPARG
SCHEMBL5216673 0.80 PPARD (0.73) PPARDPPARA

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
EP-1480640-B1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2007-08-15 EP disclosed