SCHEMBL5990271

SCHEMBL5990271

CC(CCO)Oc1ccc(C(C)C)cc1Oc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 7/20 0.41
▸ PPARD Q03181 7/20 0.41
▸ PPARA Q07869 7/20 0.41
▸ TTR P02766 1/20 0.39
▸ TNF P01375 1/20 0.36
▸ TRPA1 O75762 1/20 0.35
▸ PTGS1 P23219 1/20 0.35
▸ BCHE P06276 1/20 0.34
▸ ACHE P22303 1/20 0.34
▸ UGT2B7 P16662 1/20 0.34

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
SCHEMBL5990267 1.00 PPARG (0.41) PPARGPPARDPPARATTRTNF
SCHEMBL5991196 0.84 PPARG (0.56) PPARGPPARDPPARA
SCHEMBL5990286 0.84 PPARG (0.56) PPARGPPARDPPARA
SCHEMBL5990128 0.84 PPARG (0.56) PPARGPPARDPPARA
SCHEMBL5990452 0.83 PPARG (0.57) PPARGPPARDPPARATTR
SCHEMBL5990443 0.83 PPARG (0.57) PPARGPPARDPPARATTR
SCHEMBL5990524 0.81 PPARG (0.58) PPARGPPARDPPARA
SCHEMBL5990518 0.81 PPARG (0.58) PPARGPPARDPPARA
SCHEMBL5989110 0.80 PPARG (0.42) PPARGPPARDPPARA
SCHEMBL5989115 0.80 PPARG (0.42) 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
Send feedback