SCHEMBL6243281

SCHEMBL6243281

Cc1sc(-c2ccccc2)nc1CCOc1ccc(NC(P(=O)(O)O)P(=O)(O)O)nc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.51
PPARA Q07869 14/20 0.51
FDPS P14324 4/20 0.41
FDFT1 P37268 1/20 0.40

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
SCHEMBL6242327 0.91 PPARG (0.49) PPARGPPARAFDPSFDFT1
SCHEMBL6244782 0.89 PPARG (0.48) PPARGPPARA
SCHEMBL6244270 0.81 PPARG (0.58) PPARGPPARA
SCHEMBL14142874 0.75 PPARA (0.57) PPARGPPARA
SCHEMBL7784532 0.74 FDPS (0.52) FDPSFDFT1
SCHEMBL6242189 0.74 FDPS (0.37) PPARGFDPSFDFT1
SCHEMBL6602930 0.73 PPARG (0.64) PPARGPPARA
SCHEMBL6245782 0.72 PPARG (0.49) PPARGPPARA
SCHEMBL6262575 0.72 PPARG (0.47) PPARGPPARA
SCHEMBL20377227 0.71 FDPS (0.51) PPARGPPARAFDPSFDFT1

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
WO-2005028488-A1 HETEROARYL PHOSPHINYL AND THIOPHOSPHINYL COMPOUNDS FOR REGULATION OF GLUCOSE, TRIGLYCERIDES, AND LDL/HDL LEVELS QUATRX PHARMACEUTICALS CO. (US) 2005-03-31 WO disclosed