SCHEMBL6205683

SCHEMBL6205683

CCCc1cc(CCC)c2onc(-c3ccccc3)c2c1OC(c1ccccc1)c1nnn[nH]1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.37
PPARA Q07869 17/20 0.37
PPARD Q03181 4/20 0.31

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
SCHEMBL4013188 0.85 PPARG (0.49) PPARGPPARAPPARD
SCHEMBL6206380 0.78 PPARA (0.42) PPARGPPARA
SCHEMBL4013902 0.77 PPARA (0.66) PPARGPPARAPPARD
SCHEMBL4010340 0.71 PPARA (0.65) PPARGPPARAPPARD
SCHEMBL4013379 0.69 PPARA (0.55) PPARGPPARAPPARD
SCHEMBL4012839 0.69 PPARA (0.66) PPARGPPARAPPARD
SCHEMBL4017608 0.67 PPARA (0.55) PPARGPPARAPPARD
SCHEMBL9308272 0.65 EDNRB (0.58)
SCHEMBL13924129 0.63 PPARG (0.77) PPARGPPARA
SCHEMBL4016459 0.63 PPARG (0.77) PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1366012-A4 2-ARYLOXY-2-ARYLALKANOIC ACIDS FOR DIABETES AND LIPID DISORDERS MERCK & CO INC (US) 2005-11-02 EP disclosed
EP-1366012-A2 2-ARYLOXY-2-ARYLALKANOIC ACIDS FOR DIABETES AND LIPID DISORDERS Merck & Co., Inc. (US) 2003-12-03 EP disclosed
WO-2002064094-A2 2-ARYLOXY-2-ARYLALKANOIC ACIDS FOR DIABETES AND LIPID DISORDERS MERCK & CO., INC. (US) 2002-08-22 WO disclosed