SCHEMBL5990452

SCHEMBL5990452

CCc1ccc(OC(C)CCO)c(Oc2ccccc2)c1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 13/20 0.57
▸ PPARD Q03181 13/20 0.57
▸ PPARA Q07869 12/20 0.57
▸ TTR P02766 2/20 0.44

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
SCHEMBL5990443 1.00 PPARG (0.57) PPARGPPARDPPARATTR
SCHEMBL5990271 0.83 PPARG (0.41) PPARGPPARDPPARATTR
SCHEMBL5990286 0.83 PPARG (0.56) PPARGPPARDPPARA
SCHEMBL5990267 0.83 PPARG (0.41) PPARGPPARDPPARATTR
SCHEMBL5990128 0.83 PPARG (0.56) PPARGPPARDPPARA
SCHEMBL5991196 0.83 PPARG (0.56) PPARGPPARDPPARA
SCHEMBL5990335 0.81 PPARG (0.56) PPARGPPARDPPARA
SCHEMBL5990163 0.81 PPARG (0.56) PPARGPPARDPPARA
SCHEMBL5990165 0.81 PPARG (0.56) PPARGPPARDPPARA
SCHEMBL5990518 0.80 PPARG (0.58) 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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