SCHEMBL4754147

SCHEMBL4754147

CC(=O)C(c1ccc(O)c(C)c1)c1nc(-c2ccc(Cl)cc2Cl)oc1C(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.41
PPARD Q03181 2/20 0.41
PPARA Q07869 2/20 0.41
HSD17B10 Q99714 3/20 0.35
MAPT P10636 3/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
TSHR P16473 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
POLB P06746 1/20 0.34
CNR1 P21554 3/20 0.34
CNR2 P34972 2/20 0.34
S1PR3 Q99500 2/20 0.34
S1PR1 P21453 1/20 0.34
KDM4E B2RXH2 3/20 0.33
ACHE P22303 1/20 0.33
BACE1 P56817 1/20 0.33
FURIN P09958 1/20 0.33
ALDH1A1 P00352 2/20 0.32
TP53 P04637 2/20 0.32

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
SCHEMBL4754493 0.94 PPARG (0.35) PPARGPPARDPPARAHSD17B10MAPT
SCHEMBL4754569 0.89 PPARG (0.40) PPARGPPARDPPARAHSD17B10MAPT
SCHEMBL4754514 0.89 PPARG (0.36) PPARGPPARDPPARAHSD17B10TSHR
SCHEMBL4754503 0.82 PPARG (0.41) PPARGPPARDPPARAHSD17B10MAPT
SCHEMBL4755267 0.78 PPARG (0.42) PPARGPPARDPPARAHSD17B10MAPT
SCHEMBL4754491 0.76 PPARG (0.36) PPARGPPARDPPARAMAPTNPC1
SCHEMBL2463943 0.76 PPARG (0.48) PPARGPPARDPPARAHSD17B10MAPT
SCHEMBL2460888 0.74 PPARG (0.52) PPARGPPARDPPARAHSD17B10MAPT
SCHEMBL4754502 0.72 PPARG (0.36) PPARGPPARDPPARACNR1ACHE
SCHEMBL2466991 0.70 PPARG (0.44) PPARGPPARDPPARAHSD17B10MAPT

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