SCHEMBL4754145

SCHEMBL4754145

CC(=O)OOc1ccc(C(=O)CCc2sc(-c3cc(F)cc(F)c3)nc2C(C)C)cc1C

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 8/20 0.37
PPARA Q07869 7/20 0.37
PPARG P37231 5/20 0.37
MAPT P10636 7/20 0.35
LMNA P02545 3/20 0.35
TP53 P04637 3/20 0.35
TRPM8 Q7Z2W7 2/20 0.33
FFAR1 O14842 1/20 0.31

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
SCHEMBL4754169 0.91 PPARD (0.38) PPARDPPARAPPARGMAPTLMNA
SCHEMBL12732420 0.88 PPARD (0.40) PPARDPPARAPPARGMAPTLMNA
SCHEMBL2466101 0.87 PPARD (0.51) PPARDPPARAPPARGMAPTFFAR1
SCHEMBL4809536 0.87 PPARD (0.37) PPARDPPARAPPARGMAPTLMNA
SCHEMBL24658539 0.87 PPARD (0.38) PPARDPPARAPPARGMAPTLMNA
SCHEMBL30003459 0.87 PPARD (0.38) PPARDPPARAPPARGMAPTLMNA
SCHEMBL12732432 0.86 PPARD (0.44) PPARDPPARAPPARGMAPTLMNA
SCHEMBL1765982 0.86 PPARD (0.45) PPARDPPARAPPARGMAPTFFAR1
SCHEMBL24742580 0.85 THRA (0.38) PPARDPPARAPPARGMAPTLMNA
SCHEMBL24742071 0.84 PPARD (0.41) PPARDPPARAPPARGMAPTLMNA

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