SCHEMBL7468397

SCHEMBL7468397

Cc1nc(-c2ccc(C(C)C)cc2)sc1C(=O)NCc1ccc(OC(C)(C)C(=O)OC(=O)C(C)(C)Oc2ccc(CNC(=O)c3sc(-c4ccc(C(C)(C)C)cc4)nc3C)cc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 20/20 0.75
PPARD Q03181 8/20 0.75
PPARG P37231 5/20 0.75

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
SCHEMBL7468393 0.92 PPARA (0.88) PPARAPPARDPPARG
SCHEMBL6582869 0.89 PPARA (0.67) PPARAPPARDPPARG
SCHEMBL7474641 0.89 PPARA (0.76) PPARAPPARDPPARG
SCHEMBL6581303 0.88 PPARA (0.82) PPARAPPARDPPARG
SCHEMBL6581261 0.87 PPARA (0.81) PPARAPPARDPPARG
SCHEMBL6582310 0.86 PPARA (1.00) PPARAPPARDPPARG
SCHEMBL7465097 0.82 PPARA (0.80) PPARAPPARDPPARG
SCHEMBL7471721 0.82 PPARA (0.71) PPARAPPARDPPARG
SCHEMBL7468344 0.82 PPARA (0.67) PPARAPPARDPPARG
SCHEMBL7474631 0.81 PPARA (0.89) PPARAPPARDPPARG

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
EP-1244642-A1 SUBSTITUTED OXAZOLES AND THIAZOLES DERIVATIVES AS HPPAR ALPHA ACTIVATORS GLAXO GROUP LIMITED (GB) 2002-10-02 EP disclosed
WO-2001040207-A1 SUBSTITUTED OXAZOLES AND THIAZOLES DERIVATIVES AS HPPAR ALPHA ACTIVATORS GLAXO GROUP LIMITED (GB) 2001-06-07 WO disclosed