SCHEMBL1930447

SCHEMBL1930447

CCc1oc(-c2ccc3ccccc3c2)nc1CO[C@H]1CCCC(COC(C)(Cc2ccccc2)C(=O)O)C1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 19/20 0.39
PPARG P37231 13/20 0.39
PPARD Q03181 6/20 0.38
PTPN1 P18031 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
SCHEMBL1930445 1.00 PPARA (0.39) PPARAPPARGPPARDPTPN1
SCHEMBL13843997 1.00 PPARA (0.39) PPARAPPARGPPARDPTPN1
SCHEMBL3980959 0.96 PPARA (0.37) PPARAPPARGPPARD
SCHEMBL1928816 0.92 PPARA (0.46) PPARAPPARGPPARD
SCHEMBL1929321 0.92 PPARA (0.45) PPARAPPARGPPARD
SCHEMBL13843953 0.92 PPARA (0.46) PPARAPPARGPPARD
SCHEMBL1930111 0.92 PPARA (0.40) PPARAPPARGPPARD
SCHEMBL1930106 0.92 PPARA (0.40) PPARAPPARGPPARD
SCHEMBL1929322 0.92 PPARA (0.45) PPARAPPARGPPARD
SCHEMBL1929971 0.92 PPARA (0.46) PPARAPPARGPPARD

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-7956077-B2 2-{-3,′2-(phenyl)-oxazol-4-ylmethoxyl-cyclohexyl methoxy}-propionic acid derivatives used as peroxisome proliferator-activated receptor (PPAR) ligands for the treatment of hyperlipidemia and diabetes SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-06-07 US disclosed