SCHEMBL9536662

SCHEMBL9536662

CN(CCOc1ccc(CC2SC(=O)NC2=O)cc1)C(=O)OCCc1ccccc1.[NaH]

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 14/20 0.59
RXRA P19793 2/20 0.57
RARG P13631 1/20 0.57
FFAR1 O14842 6/20 0.53
CYP3A4 P08684 1/20 0.48
PPARA Q07869 2/20 0.48

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
SCHEMBL9532301 0.99 PPARG (0.60) PPARGRXRARARGFFAR1CYP3A4
SCHEMBL9536496 0.90 PPARG (0.61) PPARGRXRARARGFFAR1PPARA
SCHEMBL9123909 0.86 PPARG (0.61) PPARGRXRARARGFFAR1CYP3A4
SCHEMBL2699229 0.86 PPARG (0.63) PPARGRXRARARGFFAR1PPARA
SCHEMBL9121895 0.85 PPARG (0.66) PPARGRXRARARGFFAR1PPARA
SCHEMBL9120637 0.84 PPARG (0.63) PPARGRXRARARGFFAR1PPARA
SCHEMBL12515224 0.83 FFAR1 (0.69) PPARGRXRAFFAR1CYP3A4PPARA
SCHEMBL9536665 0.83 LTB4R (0.40) PPARGRXRARARGFFAR1
SCHEMBL6966428 0.82 PPARG (0.64) PPARGRXRARARGFFAR1CYP3A4
SCHEMBL9532314 0.82 LTB4R (0.41) PPARGRXRARARGFFAR1

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-0555251-A1 THIAZOLIDINE DIONE DERIVATIVES BEECHAM GROUP plc (GB) 1993-08-18 EP claimed
WO-1992007838-A1 THIAZOLIDINE DIONE DERIVATIVES BEECHAM GROUP PLC (GB) 1992-05-14 WO claimed