SCHEMBL6149533

SCHEMBL6149533

CCCCCCNC(=O)CCOc1ccc(CC(OCC)C(=O)O)cc1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 16/20 0.59
PPARG P37231 13/20 0.59
PPARD Q03181 7/20 0.59
ITGB3 P05106 1/20 0.50
ITGA2B P08514 1/20 0.50

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
SCHEMBL6150272 0.82 PPARA (0.71) PPARAPPARGPPARD
SCHEMBL5418850 0.82 STS (0.56) PPARAPPARG
SCHEMBL6150513 0.82 PPARA (0.58) PPARAPPARGPPARD
SCHEMBL5979684 0.82 ITGB3 (0.49) PPARAPPARGPPARDITGB3ITGA2B
SCHEMBL6150404 0.82 PPARA (0.50) PPARAPPARGPPARD
SCHEMBL14501937 0.82 PPARA (0.54) PPARAPPARGPPARD
SCHEMBL27654986 0.81 PPARA (0.85) PPARAPPARGPPARD
SCHEMBL5977314 0.81 PPARA (0.57) PPARAPPARGPPARD
SCHEMBL5976955 0.81 PPARA (0.57) PPARAPPARGPPARD
SCHEMBL5980971 0.81 PPARA (0.57) 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 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