Sugi Predict

Sugi Predict / Compounds / SCHEMBL5990935

SCHEMBL5990935

SCHEMBL5990935

CCc1ccc(O[C@H](CC)CCOc2ccc(CCC(=O)O)c(C)c2)c(C(=O)c2ccccc2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 20/20 1.00
▸ PPARD Q03181 20/20 1.00
▸ PPARA Q07869 16/20 1.00

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
SCHEMBL5990546 1.00 PPARG (1.00) PPARGPPARDPPARA
SCHEMBL5990541 1.00 PPARG (1.00) PPARGPPARDPPARA
SCHEMBL5990570 0.94 PPARG (1.00) PPARGPPARDPPARA
SCHEMBL5991828 0.94 PPARG (0.89) PPARGPPARDPPARA
SCHEMBL5991949 0.93 PPARG (0.86) PPARGPPARDPPARA
SCHEMBL5989286 0.91 PPARG (1.00) PPARGPPARDPPARA
SCHEMBL5989291 0.89 PPARG (0.81) PPARGPPARDPPARA
SCHEMBL5403316 0.88 PPARG (0.92) PPARGPPARDPPARA
SCHEMBL5990382 0.87 PPARG (0.77) PPARGPPARDPPARA
SCHEMBL5392662 0.87 PPARG (0.77) 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
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