SCHEMBL4755262

SCHEMBL4755262

CCCC(=O)OOc1ccc(C(=O)CCc2nc(-c3ccc(Cl)cc3O)oc2C(C)C)cc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.46
PPARD Q03181 5/20 0.46
PPARA Q07869 5/20 0.46
MAPT P10636 3/20 0.32
GAA P10253 2/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HSD17B10 Q99714 2/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
S1PR1 P21453 2/20 0.32
S1PR3 Q99500 2/20 0.32
S1PR5 Q9H228 2/20 0.32
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31
PDE4B Q07343 2/20 0.31
PDE11A Q9HCR9 2/20 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
SCHEMBL12732399 0.88 PPARG (0.49) PPARGPPARDPPARAMAPTGAA
SCHEMBL20815372 0.86 PPARD (0.47) PPARGPPARDPPARAMAPTNPC1
SCHEMBL4755260 0.85 PPARG (0.49) PPARGPPARDPPARAMAPTSMN1; SMN2
SCHEMBL2463427 0.84 PPARG (0.46) PPARGPPARDPPARAMAPTGAA
SCHEMBL24658330 0.84 PPARG (0.48) PPARGPPARDPPARAMAPTGAA
SCHEMBL4755223 0.84 PPARA (0.53) PPARGPPARDPPARAMAPTNPC1
SCHEMBL2460899 0.84 PPARD (0.59) PPARGPPARDPPARAMAPTKDM4E
SCHEMBL30003514 0.84 PPARG (0.48) PPARGPPARDPPARAMAPTGAA
SCHEMBL2491414 0.84 PPARG (0.45) PPARGPPARDPPARAMAPTGAA
SCHEMBL1765866 0.83 PPARA (0.45) PPARGPPARDPPARAMAPTNPC1

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