SCHEMBL28868236

SCHEMBL28868236

Cc1cc(C(=O)CCc2sc(-c3ccc(C(F)(F)F)cc3)nc2C(C)C)c(O)cc1OCC(=O)O

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 20/20 0.56
PPARA Q07869 10/20 0.56
PPARG P37231 6/20 0.56
FFAR1 O14842 1/20 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
SCHEMBL30008368 1.00 PPARD (0.56) PPARDPPARAPPARGFFAR1
SCHEMBL30007469 0.91 PPARD (0.53) PPARDPPARAPPARGFFAR1
SCHEMBL28868240 0.91 PPARD (0.53) PPARDPPARAPPARGFFAR1
SCHEMBL28868243 0.87 PPARD (0.49) PPARDPPARAPPARGFFAR1
SCHEMBL2462565 0.87 PPARD (0.56) PPARDPPARAPPARGFFAR1
SCHEMBL1673096 0.87 PPARD (0.62) PPARDPPARAPPARGFFAR1
SCHEMBL1765914 0.85 PPARD (0.57) PPARDPPARAPPARGFFAR1
SCHEMBL12801426 0.82 PPARD (0.73) PPARDPPARAPPARGFFAR1
SCHEMBL30008095 0.82 PPARD (0.45) PPARDPPARAPPARGFFAR1
SCHEMBL28868232 0.82 PPARD (0.45) 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 2 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-A Preparation method of PPAR delta agonist finadepa and intermediate thereof 沈阳药科大学 2022-10-21 CN disclosed