SCHEMBL2353696

SCHEMBL2353696

CCC(C)(OCc1ccc(/C=C/Cn2cccc2C(=O)c2ccc(C)cc2)cc1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.54
PPARA Q07869 8/20 0.54
NPC1 O15118 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
ALOX12 P18054 1/20 0.34
RECQL P46063 1/20 0.34
KMT2A Q03164 1/20 0.34
RAB9A P51151 1/20 0.34
GHSR Q92847 1/20 0.34

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
SCHEMBL2353699 1.00 PPARG (0.54) PPARGPPARANPC1SMN1; SMN2ALDH1A1
SCHEMBL475127 0.91 PPARG (0.56) PPARGPPARANPC1ALDH1A1MEN1
SCHEMBL2978389 0.91 PPARG (0.56) PPARGPPARANPC1ALDH1A1MEN1
SCHEMBL475130 0.91 PPARG (0.56) PPARGPPARANPC1ALDH1A1MEN1
SCHEMBL13994554 0.86 PPARG (0.50) PPARGPPARANPC1ALDH1A1MEN1
SCHEMBL2719917 0.85 PPARG (0.52) PPARGPPARANPC1ALDH1A1RAB9A
SCHEMBL2978823 0.85 PPARG (0.52) PPARGPPARANPC1ALDH1A1RAB9A
SCHEMBL2719920 0.85 PPARG (0.52) PPARGPPARANPC1ALDH1A1RAB9A
SCHEMBL2980280 0.85 PPARG (0.52) PPARGPPARANPC1ALDH1A1MEN1
SCHEMBL2980279 0.85 PPARG (0.52) PPARGPPARANPC1ALDH1A1MEN1

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
EP-2351563-A1 AGENT FOR TREATMENT OF DIABETES Dainippon Sumitomo Pharma Co., Ltd. (JP) 2011-08-03 EP disclosed