SCHEMBL5989015

SCHEMBL5989015

CCc1ccc(OC(C)CCOS(C)(=O)=O)c([S+]([O-])c2ccccc2)c1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 16/20 0.38
▸ PPARD Q03181 16/20 0.38
▸ PPARA Q07869 14/20 0.38
▸ PTGDR2 Q9Y5Y4 1/20 0.31

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
SCHEMBL5991756 1.00 PPARG (0.38) PPARGPPARDPPARAPTGDR2
SCHEMBL5989709 0.82 PPARG (0.38) PPARGPPARDPPARA
SCHEMBL5988927 0.82 PPARG (0.38) PPARGPPARDPPARA
SCHEMBL5989715 0.82 PPARG (0.38) PPARGPPARDPPARA
SCHEMBL6054881 0.82 PPARG (0.33) PPARGPPARDPPARA
SCHEMBL5990335 0.78 PPARG (0.56) PPARGPPARDPPARA
SCHEMBL5990165 0.78 PPARG (0.56) PPARGPPARDPPARA
SCHEMBL5990163 0.78 PPARG (0.56) PPARGPPARDPPARA
SCHEMBL5989827 0.76 PPARG (0.63) PPARGPPARDPPARA
SCHEMBL5989831 0.76 PPARG (0.63) 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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