SCHEMBL24658337

SCHEMBL24658337

Cc1ccc(C(=O)CCc2sc(-c3ccc(C(F)(F)F)cc3)nc2C(C)C)cc1OC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 16/20 0.56
PPARA Q07869 15/20 0.56
PPARG P37231 10/20 0.56
MAPT P10636 3/20 0.43
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
HSP90AA1 P07900 1/20 0.40
CRHBP P24387 1/20 0.40
KMT2A Q03164 1/20 0.40
CRHR2 Q13324 1/20 0.40
FFAR1 O14842 1/20 0.40

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
SCHEMBL24742435 0.93 PPARD (0.54) PPARDPPARAPPARGMAPTFFAR1
SCHEMBL1765848 0.93 PPARA (0.66) PPARDPPARAPPARG
SCHEMBL12732444 0.93 PPARD (0.57) PPARDPPARAPPARGMAPTFFAR1
SCHEMBL2464886 0.90 PPARD (0.55) PPARDPPARAPPARGMAPTKDM4E
SCHEMBL24742378 0.89 PPARD (0.49) PPARDPPARAPPARGMAPTKDM4E
SCHEMBL2462565 0.88 PPARD (0.56) PPARDPPARAPPARGFFAR1
SCHEMBL12732450 0.88 PPARD (0.49) PPARDPPARAPPARGMAPTFFAR1
SCHEMBL2464420 0.86 PPARD (0.60) PPARDPPARAPPARGMAPTFFAR1
SCHEMBL2466100 0.86 PPARD (0.54) PPARDPPARAPPARGMAPTKDM4E
SCHEMBL24742581 0.86 PPARD (0.54) PPARDPPARAPPARGMAPT

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-2022189856-A9 COMPOUNDS USEFUL FOR TREATING LIVER DISEASES ABIONYX PHARMA SA (FR) 2022-10-13 WO disclosed