SCHEMBL6994584

SCHEMBL6994584

CC(C)(Oc1ccc(OCCc2coc(-c3ccc(C(C)(C)C)c(O)c3C(C)(C)C)n2)cc1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 18/20 0.46
PPARG P37231 11/20 0.46
PPARD Q03181 12/20 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
SCHEMBL6995735 0.89 PPARA (0.40) PPARAPPARGPPARD
SCHEMBL5105508 0.84 PPARA (0.50) PPARAPPARGPPARD
SCHEMBL5099341 0.79 PPARG (0.67) PPARAPPARGPPARD
SCHEMBL7139083 0.74 PPARG (0.60) PPARAPPARGPPARD
SCHEMBL5105209 0.73 PPARA (0.43) PPARAPPARGPPARD
SCHEMBL7139081 0.71 PPARA (0.55) PPARAPPARGPPARD
SCHEMBL5112892 0.71 PPARA (0.55) PPARAPPARGPPARD
SCHEMBL7139077 0.71 PPARA (0.55) PPARAPPARGPPARD
SCHEMBL6958967 0.70 PPARG (0.44) PPARAPPARG
SCHEMBL14176222 0.69 PPARA (0.56) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1313715-A1 OXAZOLYL-ARYLOXYACETIC ACID DERIVATIVES AND THEIR USE AS PPAR AGONISTS ELI LILLY AND COMPANY (US) 2003-05-28 EP disclosed
WO-2002018355-A1 OXAZOLYL-ARYLOXYACETIC ACID DERIVATIVES AND THEIR USE AS PPAR AGONISTS ELI LILLY AND COMPANY (US) 2002-03-07 WO disclosed