SCHEMBL4754541

SCHEMBL4754541

CCc1cc(OC(C)(C)C(=O)O)ccc1C(=O)CCc1sc(-c2cc(F)cc(F)c2)nc1C(C)C

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 20/20 0.49
PPARD Q03181 13/20 0.49
PPARG P37231 9/20 0.49

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
SCHEMBL2464908 0.79 PPARA (0.65) PPARAPPARDPPARG
SCHEMBL1765987 0.79 PPARD (0.51) PPARAPPARDPPARG
SCHEMBL4754485 0.77 PPARD (0.47) PPARAPPARDPPARG
SCHEMBL12732549 0.76 PPARA (0.52) PPARAPPARDPPARG
SCHEMBL2464909 0.75 PPARA (0.50) PPARAPPARDPPARG
SCHEMBL4754486 0.75 MAPT (0.36) PPARAPPARDPPARG
SCHEMBL376650 0.74 PPARA (0.64) PPARAPPARDPPARG
SCHEMBL12732412 0.73 PPARA (0.56) PPARAPPARDPPARG
SCHEMBL12732432 0.72 PPARD (0.44) PPARAPPARDPPARG
SCHEMBL2466223 0.72 PPARG (0.43) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008154023-A1 NOVEL USES OF PPAR DELTA AGONISTS CERENIS THERAPEUTICS S.A. (FR) 2008-12-18 WO disclosed