SCHEMBL14560751

SCHEMBL14560751

CO[C@@H](Cc1ccc(C#CCOc2ccc(Oc3ccccc3)cc2)cc1)C(C)=O

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 14/20 0.68
PPARG P37231 11/20 0.68
PPARD Q03181 10/20 0.68
ACACB O00763 5/20 0.54
FFAR1 O14842 1/20 0.47

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
SCHEMBL5375792 0.92 PPARA (0.80) PPARAPPARGPPARDACACBFFAR1
SCHEMBL5375797 0.92 PPARA (0.80) PPARAPPARGPPARDACACBFFAR1
SCHEMBL14560737 0.91 PPARA (0.59) PPARAPPARGPPARDACACB
SCHEMBL14560768 0.88 PPARA (0.86) PPARAPPARGPPARDACACBFFAR1
SCHEMBL14560864 0.84 PPARG (0.76) PPARAPPARGPPARDACACB
SCHEMBL14560831 0.83 PPARG (0.83) PPARAPPARGPPARDACACB
SCHEMBL14560732 0.83 PPARG (0.83) PPARAPPARGPPARDACACB
SCHEMBL6574322 0.83 PPARA (0.70) PPARAPPARGPPARDACACB
SCHEMBL5392011 0.83 PPARG (0.70) PPARAPPARGPPARD
SCHEMBL5385194 0.83 PPARA (0.66) PPARAPPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7192982-B2 Modulators of peroxisome proliferator activated receptors LIGAND PHARMACEUTICALS, INC. (US) 2007-03-20 US disclosed