SCHEMBL6660840

SCHEMBL6660840

CCO[C@@H](Cc1ccc(OC(C)CC(=O)NCCc2cccc(C(F)(F)F)c2)cc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 16/20 0.49
PPARG P37231 13/20 0.49
PPARD Q03181 5/20 0.47
TACR1 P25103 1/20 0.43
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL6658216 0.91 PPARA (0.51) PPARAPPARGPPARDTACR1KDM4E
SCHEMBL14501884 0.88 PPARA (0.51) PPARAPPARGPPARDKDM4EMEN1
SCHEMBL14501935 0.88 PPARA (0.51) PPARAPPARGPPARDKDM4EMEN1
SCHEMBL6660845 0.88 PPARA (0.53) PPARAPPARGPPARDKDM4EMEN1
SCHEMBL5360256 0.88 PPARA (0.51) PPARAPPARGPPARDKDM4EMEN1
SCHEMBL6150631 0.87 PPARA (0.47) PPARAPPARGPPARDMEN1KMT2A
SCHEMBL6659254 0.85 PPARA (0.54) PPARAPPARGPPARDMEN1KMT2A
SCHEMBL6661862 0.83 PPARA (0.51) PPARAPPARGPPARD
SCHEMBL5357732 0.82 PPARA (0.48) PPARAPPARGPPARDKDM4EMEN1
SCHEMBL6150739 0.82 PPARA (0.53) PPARAPPARGTACR1KDM4EMEN1

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
WO-2004000789-A9 AMIDE LINKER PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2004-03-11 WO claimed
WO-2004000789-A9 AMIDE LINKER PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR MODULATORS LILLY CO ELI (US) 2004-03-11 WO disclosed