SCHEMBL5186341

SCHEMBL5186341

CCC[As](CC(C)Oc1ccc(CCC(=O)O)c(OC)c1)S(=O)(=O)c1sc2ccc(Cl)cc2c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.41
PPARD Q03181 5/20 0.41
PPARA Q07869 5/20 0.41
CMA1 P23946 6/20 0.39
SLC2A1 P11166 1/20 0.37
PFKFB3 Q16875 6/20 0.36
PFKFB4 Q16877 5/20 0.36
HTR1A P08908 1/20 0.34
DRD2 P14416 1/20 0.34
HTR1D P28221 1/20 0.34
HTR1B P28222 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR1E P28566 1/20 0.34
HTR1F P30939 1/20 0.34
HTR7 P34969 1/20 0.34
ADRA1B P35368 1/20 0.34
DRD3 P35462 1/20 0.34
HTR2B P41595 1/20 0.34
HTR6 P50406 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
SCHEMBL3684098 0.82 SLC2A1 (0.42) PPARGPPARDPPARACMA1SLC2A1
SCHEMBL3695623 0.73 PPARG (0.42) PPARGPPARDPPARACMA1SLC2A1
SCHEMBL3691091 0.68 PPARD (0.43) PPARGPPARDPPARACMA1SLC2A1
SCHEMBL3690029 0.68 PPARG (0.40) PPARGPPARDPPARACMA1SLC2A1
SCHEMBL3689304 0.67 PFKFB3 (0.41) PPARGPPARDPPARACMA1SLC2A1
SCHEMBL3683554 0.67 PPARD (0.44) PPARGPPARDPPARACMA1PFKFB3
SCHEMBL5330312 0.66 CMA1 (0.52) CMA1PFKFB3PFKFB4HTR1ADRD2
SCHEMBL3683400 0.66 PPARD (0.43) PPARGPPARDPPARACMA1PFKFB3
SCHEMBL7018250 0.65 PFKFB3 (0.53) CMA1PFKFB3PFKFB4
SCHEMBL3689885 0.64 SLC2A1 (0.40) CMA1SLC2A1PFKFB3PFKFB4HTR1A

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-1597248-B1 SULFONAMIDE DERIVATIVES AS PPAR MODULATORS LILLY CO ELI (US) 2007-12-26 EP disclosed