SCHEMBL5989893

SCHEMBL5989893

CCOC(=O)C(C)(C)Oc1ccc(OCCC(C)Oc2ccc(CC)cc2C(=O)c2ccccc2)cc1C

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 20/20 0.72
▸ PPARD Q03181 20/20 0.72
▸ PPARA Q07869 17/20 0.72

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
SCHEMBL5990844 0.93 PPARG (0.84) PPARGPPARDPPARA
SCHEMBL5990218 0.91 PPARG (0.73) PPARGPPARDPPARA
SCHEMBL6054851 0.90 PPARG (0.67) PPARGPPARDPPARA
SCHEMBL6054849 0.88 PPARG (0.76) PPARGPPARDPPARA
SCHEMBL5989089 0.85 PPARG (0.77) PPARGPPARDPPARA
SCHEMBL5990132 0.85 PPARG (0.71) PPARGPPARDPPARA
SCHEMBL5402182 0.84 PPARG (1.00) PPARGPPARDPPARA
SCHEMBL5989481 0.83 PPARG (0.69) PPARGPPARDPPARA
SCHEMBL5988805 0.82 PPARG (0.67) PPARGPPARDPPARA
SCHEMBL5988789 0.82 PPARG (0.86) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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