SCHEMBL2070902

SCHEMBL2070902

CCC(Oc1ccc(Sc2cc(C#Cc3ccc(C(F)(F)F)cc3)cc(C#Cc3ccc(C(F)(F)F)cc3)n2)cc1C)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 19/20 0.53
PPARA Q07869 8/20 0.53
PPARG P37231 3/20 0.53
PTGDR2 Q9Y5Y4 1/20 0.42

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
SCHEMBL2068479 0.84 PPARD (0.66) PPARDPPARAPPARG
SCHEMBL2069381 0.83 PPARA (0.46) PPARDPPARAPPARGPTGDR2
SCHEMBL2822183 0.79 PPARD (0.44) PPARDPPARAPPARGPTGDR2
SCHEMBL12590669 0.78 PPARD (0.77) PPARDPPARAPPARG
SCHEMBL2822186 0.78 PPARD (0.43) PPARDPPARAPPARG
SCHEMBL2167562 0.76 PPARD (0.66) PPARDPPARAPPARG
SCHEMBL2070336 0.75 PTGDR2 (0.42) PPARDPPARAPPARGPTGDR2
SCHEMBL2068734 0.74 PPARA (0.40) PPARDPPARAPPARGPTGDR2
SCHEMBL2070877 0.74 PPARA (0.43) PPARDPPARAPPARGPTGDR2
SCHEMBL2068744 0.74 PPARA (0.41) PPARDPPARAPPARGPTGDR2

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-7968723-B2 Compounds, their preparation and use HIGH POINT PHARMACEUTICALS, LLC (US) 2011-06-28 US disclosed