SCHEMBL7665347

SCHEMBL7665347

CCCc1c(OCCCCOc2cccc(N3C(=O)SC(=O)C3F)c2)ccc2c(CCc3ccccc3)coc12

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 18/20 0.43
PPARG P37231 17/20 0.43
PPARD Q03181 17/20 0.43
PDE5A O76074 2/20 0.36

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
SCHEMBL7671701 0.92 PPARA (0.43) PPARAPPARGPPARDPDE5A
SCHEMBL7663368 0.89 PPARA (0.40) PPARAPPARGPPARD
SCHEMBL7669108 0.86 PPARG (0.39) PPARAPPARGPPARD
SCHEMBL5211567 0.84 PPARA (0.43) PPARAPPARGPPARDPDE5A
SCHEMBL7670010 0.81 PPARA (0.40) PPARAPPARGPPARDPDE5A
SCHEMBL7668178 0.79 PPARG (0.39) PPARAPPARGPPARD
SCHEMBL5211565 0.78 PPARG (0.61) PPARAPPARGPPARD
SCHEMBL7454425 0.77 PPARG (0.43) PPARAPPARGPPARDPDE5A
SCHEMBL5205501 0.77 PPARA (0.57) PPARAPPARGPPARD
SCHEMBL7464894 0.77 PPARG (0.42) PPARAPPARGPPARDPDE5A

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-6399640-B1 ANTIDIABETIC AGENTS; ANTICHOLESTEROL AGENTS MERCK & CO., INC. 2002-06-04 US claimed