SCHEMBL5990103

SCHEMBL5990103

Cc1cc(CCC(=O)O)ccc1OCC[C@@H](C)Oc1ccc(Cl)cc1Oc1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.73
PPARD Q03181 12/20 0.73
PPARA Q07869 12/20 0.73
FFAR4 Q5NUL3 7/20 0.54
FFAR1 O14842 5/20 0.54

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
SCHEMBL5990106 1.00 PPARG (0.73) PPARGPPARDPPARAFFAR4FFAR1
SCHEMBL5989723 0.91 PPARG (0.73) PPARGPPARDPPARAFFAR4FFAR1
SCHEMBL5989726 0.91 PPARG (0.73) PPARGPPARDPPARAFFAR4FFAR1
SCHEMBL5989519 0.91 PPARG (0.65) PPARGPPARDPPARAFFAR4FFAR1
SCHEMBL5989516 0.91 PPARG (0.65) PPARGPPARDPPARAFFAR4FFAR1
SCHEMBL5991581 0.90 PPARG (0.67) PPARGPPARDPPARAFFAR4FFAR1
SCHEMBL5991590 0.90 PPARG (0.67) PPARGPPARDPPARAFFAR4FFAR1
SCHEMBL5411425 0.90 PPARG (0.77) PPARGPPARDPPARAFFAR4FFAR1
SCHEMBL5411420 0.90 PPARG (0.77) PPARGPPARDPPARAFFAR4FFAR1
SCHEMBL5991879 0.89 PPARG (0.75) PPARGPPARDPPARAFFAR4FFAR1

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