SCHEMBL5798491

SCHEMBL5798491

CCON=C(COc1ccc(CC(OCC)C(=O)O)cc1)c1cc(-c2ccccc2)no1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 20/20 0.55
▸ PPARG P37231 16/20 0.55
▸ PPARD Q03181 11/20 0.49

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
SCHEMBL5798489 1.00 PPARA (0.55) PPARAPPARGPPARD
SCHEMBL5822695 0.92 PPARA (0.47) PPARAPPARGPPARD
SCHEMBL5822692 0.92 PPARA (0.47) PPARAPPARGPPARD
SCHEMBL5813111 0.85 PPARG (0.52) PPARAPPARGPPARD
SCHEMBL5813107 0.85 PPARG (0.52) PPARAPPARGPPARD
SCHEMBL5799344 0.84 PPARA (0.48) PPARAPPARGPPARD
SCHEMBL5799340 0.84 PPARA (0.48) PPARAPPARGPPARD
SCHEMBL5798082 0.82 PPARA (0.64) PPARAPPARGPPARD
SCHEMBL5798078 0.82 PPARA (0.64) PPARAPPARGPPARD
SCHEMBL5801764 0.82 PPARA (0.61) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006057503-A1 NOVEL COMPOUNDS AS AGONIST FOR PPARϜ AND PPARα, METHOD FOR PREPARATION OF THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES, LTD. (KR) 2006-06-01 — — WO claimed
WO-2006057503-A1 NOVEL COMPOUNDS AS AGONIST FOR PPARϜ AND PPARα, METHOD FOR PREPARATION OF THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES, LTD. (KR) 2006-06-01 — — WO disclosed
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