SCHEMBL5391041

SCHEMBL5391041

CCc1ccc(OCCCOc2ccc(CCC(=O)O)c(C)c2)c(C(=O)c2cccc3ccccc23)c1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 18/20 0.61
▸ PPARD Q03181 18/20 0.61
▸ PPARA Q07869 15/20 0.61
▸ CNR2 P34972 2/20 0.49
▸ CNR1 P21554 1/20 0.48

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
SCHEMBL5399922 0.89 PPARG (0.79) PPARGPPARDPPARA
SCHEMBL5392662 0.87 PPARG (0.77) PPARGPPARDPPARA
SCHEMBL5394453 0.85 PPARG (0.60) PPARGPPARDPPARA
SCHEMBL5990044 0.84 PPARD (0.59) PPARGPPARDPPARA
SCHEMBL5387810 0.82 PPARG (0.65) PPARGPPARDPPARA
SCHEMBL5396569 0.82 PPARG (0.60) PPARGPPARDPPARA
SCHEMBL5394417 0.81 PPARG (0.66) PPARGPPARDPPARA
SCHEMBL5403303 0.81 PPARG (0.63) PPARGPPARDPPARA
SCHEMBL5402229 0.80 PPARG (0.77) PPARGPPARDPPARA
SCHEMBL5990270 0.79 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2007502815-A — — 2007-02-15 — — JP claimed
US-20060257987-A1 Ppar modulators ELI LILLY AND COMPANY 2006-11-16 — — US claimed
EP-1660428-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2006-05-31 — — EP claimed
WO-2005019151-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-03-03 — — WO 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
Send feedback