SCHEMBL5990093

SCHEMBL5990093

Cc1cc(OCCC(C)Oc2ccc(F)cc2C(=O)c2ccccc2)ccc1CCC(=O)O

nearest known ligand 0.80

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.80
PPARD Q03181 20/20 0.80
PPARA Q07869 17/20 0.80

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
SCHEMBL5993427 1.00 PPARG (0.80) PPARGPPARDPPARA
SCHEMBL5402240 0.92 PPARG (0.80) PPARGPPARDPPARA
SCHEMBL5989464 0.91 PPARG (0.82) PPARGPPARDPPARA
SCHEMBL5394641 0.91 PPARG (0.82) PPARGPPARDPPARA
SCHEMBL5992166 0.90 PPARG (0.81) PPARGPPARDPPARA
SCHEMBL5407962 0.90 PPARG (0.82) PPARGPPARDPPARA
SCHEMBL5989661 0.90 PPARG (0.80) PPARGPPARDPPARA
SCHEMBL5387368 0.90 PPARG (0.80) PPARGPPARDPPARA
SCHEMBL5399488 0.90 PPARG (0.80) PPARGPPARDPPARA
SCHEMBL5990931 0.89 PPARG (0.79) PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060257987-A1 Ppar modulators ELI LILLY AND COMPANY 2006-11-16 US claimed
US-20060257987-A1 Ppar modulators ELI LILLY AND COMPANY 2006-11-16 US disclosed
EP-1660428-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2006-05-31 EP disclosed
WO-2005019151-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-03-03 WO disclosed