SCHEMBL8935937

SCHEMBL8935937

CCC[C@](C)(Oc1ccccc1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.53
PPARA Q07869 9/20 0.53
ADORA3 P0DMS8 1/20 0.46
ELANE P08246 2/20 0.41
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPT P10636 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL82055 1.00 PPARG (0.53) PPARGPPARAADORA3ELANENPSR1
SCHEMBL4550641 0.90 PPARA (0.54) PPARGPPARAADORA3
SCHEMBL3966243 0.88 PPARA (0.52) PPARGPPARAADORA3
SCHEMBL11548438 0.88 ADORA3 (0.48) PPARGPPARAADORA3ELANEL3MBTL1
SCHEMBL29129794 0.87 PPARG (0.51) PPARGPPARA
SCHEMBL5531801 0.86 ADORA3 (0.47) PPARGPPARAADORA3ELANEMEN1
SCHEMBL9417313 0.86 PPARA (0.53) PPARGPPARAADORA3ELANEMEN1
SCHEMBL1960387 0.85 PPARG (0.62) PPARGPPARAADORA3ELANENPSR1
SCHEMBL4852302 0.85 PPARA (0.49) PPARGPPARAADORA3ELANEMEN1
SCHEMBL2560059 0.85 L3MBTL1 (0.50) PPARGPPARAADORA3ELANENPSR1

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
US-5491167-A INHIBITORS OF CHOLESTEROL BIOSYNTHESIS SANKYO COMPANY, LIMITED (JP) 1996-02-13 US disclosed