SCHEMBL5990814

SCHEMBL5990814

C[C@H](CCOc1ccc(CC(F)(F)C(=O)O)cc1)Oc1ccc(Cl)cc1Oc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 19/20 0.64
PPARD Q03181 16/20 0.64
PPARG P37231 15/20 0.64
ACACB O00763 1/20 0.40

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
SCHEMBL5990821 1.00 PPARA (0.64) PPARAPPARDPPARGACACB
SCHEMBL5990052 0.85 PPARG (0.68) PPARAPPARDPPARGACACB
SCHEMBL5990058 0.85 PPARG (0.68) PPARAPPARDPPARGACACB
SCHEMBL5411425 0.84 PPARG (0.77) PPARAPPARDPPARG
SCHEMBL5411420 0.84 PPARG (0.77) PPARAPPARDPPARG
SCHEMBL5990252 0.80 PPARA (0.64) PPARAPPARDPPARG
SCHEMBL5990249 0.80 PPARA (0.64) PPARAPPARDPPARG
SCHEMBL5988827 0.79 PPARG (0.67) PPARAPPARDPPARG
SCHEMBL5988824 0.79 PPARG (0.67) PPARAPPARDPPARG
SCHEMBL5990927 0.78 PPARG (0.59) PPARAPPARDPPARGACACB

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060257987-A1 Ppar modulators ELI LILLY AND COMPANY 2006-11-16 US 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