SCHEMBL28868243

SCHEMBL28868243

Cc1cc(C(=O)CCc2sc(-c3ccc(C(F)(F)F)cc3)nc2C(C)C)c(O)cc1O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 11/20 0.49
PPARA Q07869 10/20 0.49
PPARG P37231 7/20 0.49
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
HSP90AA1 P07900 1/20 0.43
CRHBP P24387 1/20 0.43
KMT2A Q03164 1/20 0.43
CRHR2 Q13324 1/20 0.43
FFAR1 O14842 5/20 0.43
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 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
SCHEMBL28868232 0.89 PPARD (0.45) PPARDPPARAPPARGMAPTKDM4E
SCHEMBL30008095 0.89 PPARD (0.45) PPARDPPARAPPARGMAPTKDM4E
SCHEMBL28868236 0.87 PPARD (0.56) PPARDPPARAPPARGFFAR1
SCHEMBL30008368 0.87 PPARD (0.56) PPARDPPARAPPARGFFAR1
SCHEMBL28868230 0.87 PPARD (0.45) PPARDPPARAPPARGMAPTKDM4E
SCHEMBL1673291 0.87 PPARD (0.49) PPARDPPARAPPARGMAPTKDM4E
SCHEMBL1765953 0.85 PPARD (0.49) PPARDPPARAPPARGMAPTKDM4E
SCHEMBL2492189 0.82 PPARD (0.50) PPARDPPARAPPARGMAPTKDM4E
SCHEMBL4754459 0.81 PPARD (0.49) PPARDPPARAPPARGMAPTKDM4E
SCHEMBL24658532 0.81 PPARD (0.51) PPARDPPARAPPARGFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115215856-A Preparation method of PPAR delta agonist finadepa and intermediate thereof 沈阳药科大学 2022-10-21 CN claimed
CN-115215856-B Preparation method of PPAR delta agonist Funadepad and intermediate thereof 沈阳药科大学 2024-10-11 CN disclosed
CN-115215856-A Preparation method of PPAR delta agonist finadepa and intermediate thereof 沈阳药科大学 2022-10-21 CN disclosed