SCHEMBL6151263

SCHEMBL6151263

CCOC(=O)[C@H](Cc1ccc(OCCC(=O)OCc2ccccc2)cc1)OCC

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 12/20 0.58
PPARG P37231 10/20 0.58
PPARD Q03181 5/20 0.58
LTA4H P09960 5/20 0.51
POLB P06746 1/20 0.48
LMNA P02545 1/20 0.48
L3MBTL1 Q9Y468 1/20 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
SCHEMBL6151261 1.00 PPARA (0.58) PPARAPPARGPPARDLTA4HPOLB
SCHEMBL3956814 0.89 PPARA (0.61) PPARAPPARGPPARDLMNAL3MBTL1
SCHEMBL5338861 0.87 PPARA (0.75) PPARAPPARGPPARDLTA4HLMNA
SCHEMBL4758109 0.87 PPARA (0.75) PPARAPPARGPPARDLTA4HLMNA
SCHEMBL15811673 0.87 PPARA (0.75) PPARAPPARGPPARDLTA4HLMNA
SCHEMBL4756258 0.86 PPARA (0.61) PPARAPPARGPPARDLMNAL3MBTL1
Hydrochloric Acid SCHEMBL7212899 0.86 PPARA (0.73) PPARAPPARGPPARDLTA4HLMNA
Hydrochloric Acid SCHEMBL7212895 0.86 PPARA (0.73) PPARAPPARGPPARDLTA4HLMNA
SCHEMBL4756299 0.85 PPARA (0.63) PPARAPPARGPPARDLMNAL3MBTL1
SCHEMBL5993658 0.85 PPARA (0.66) PPARAPPARGPPARDLMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1517882-A1 AMIDE LINKER PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2005-03-30 EP disclosed
WO-2004000789-A9 AMIDE LINKER PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2004-03-11 WO disclosed
WO-2004000789-A1 AMIDE LINKER PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2003-12-31 WO disclosed