SCHEMBL5989566

SCHEMBL5989566

CC[C@@H](O)CCOc1ccc(CCC(=O)OC)c(C)c1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.44
PPARD Q03181 19/20 0.44
PPARA Q07869 15/20 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
SCHEMBL5989025 1.00 PPARG (0.44) PPARGPPARDPPARA
SCHEMBL5989029 1.00 PPARG (0.44) PPARGPPARDPPARA
SCHEMBL5989735 0.88 PPARG (0.46) PPARGPPARDPPARA
SCHEMBL5989730 0.88 PPARG (0.46) PPARGPPARDPPARA
SCHEMBL5990359 0.84 PPARG (0.43) PPARGPPARDPPARA
SCHEMBL5990406 0.82 PPARG (0.47) PPARGPPARDPPARA
SCHEMBL5990210 0.82 PPARG (0.47) PPARGPPARDPPARA
SCHEMBL5991064 0.82 PPARG (0.47) PPARGPPARDPPARA
SCHEMBL5988709 0.81 KMT2A (0.44) PPARGPPARDPPARA
SCHEMBL5989885 0.80 PPARG (0.46) 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