SCHEMBL5227831

SCHEMBL5227831

CC(=O)ON(Cc1cccc(OCCc2nc(-c3ccc(C(F)(F)F)cc3)oc2C)c1)S(=O)(=O)N1CCN(C)CC1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.52
PPARA Q07869 20/20 0.52
CYP2C9 P11712 5/20 0.49
KCNH2 Q12809 4/20 0.49
CYP3A4 P08684 4/20 0.46
CYP2C19 P33261 2/20 0.45

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
SCHEMBL5229702 0.95 PPARG (0.51) PPARGPPARACYP2C9KCNH2CYP3A4
SCHEMBL5227996 0.94 PPARG (0.49) PPARGPPARACYP2C9KCNH2CYP3A4
SCHEMBL5259761 0.92 PPARA (0.53) PPARGPPARACYP2C9KCNH2
SCHEMBL5230234 0.89 PPARG (0.57) PPARGPPARACYP2C9KCNH2
SCHEMBL5227897 0.88 PPARG (0.56) PPARGPPARACYP2C9KCNH2
SCHEMBL5228999 0.88 PPARA (0.50) PPARGPPARACYP2C9KCNH2CYP3A4
SCHEMBL5227677 0.87 PPARG (0.58) PPARGPPARACYP2C9KCNH2CYP3A4
SCHEMBL5227322 0.87 PPARG (0.54) PPARGPPARACYP2C9KCNH2
SCHEMBL5263970 0.87 PPARA (0.49) PPARGPPARACYP2C9KCNH2CYP3A4
SCHEMBL5227014 0.85 PPARG (0.55) PPARGPPARACYP2C9KCNH2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778654-A1 SULFAMIDE DERIVATIVES AND PHARMACEUTICAL COMPOSITION FOR UPREGULATION OF LIPID METABOLISM COMPRISING SAME Crystalgenomics, Inc. (KR) 2007-05-02 EP disclosed
WO-2006006832-A1 SULFAMIDE DERIVATIVES AND PHARMACEUTICAL COMPOSITION FOR UPREGULATION OF LIPID METABOLISM COMPRISING SAME CRYSTALGENOMICS, INC. (KR) 2006-01-19 WO disclosed