SCHEMBL6232363

SCHEMBL6232363

CCc1cccc(OC(C)=O)c1OCCCc1cn(-c2ccc(Cl)cn2)nc1C(CC)CC

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.33
PPARA Q07869 1/20 0.33
PTPN1 P18031 1/20 0.31
MCL1 Q07820 2/20 0.31
PDE10A Q9Y233 1/20 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
SCHEMBL6034666 0.93 PPARG (0.36) PPARGPPARAPTPN1PDE10A
SCHEMBL6215845 0.93 PTPN1 (0.41) PPARGPPARAPTPN1MCL1
SCHEMBL6221713 0.93 KDM4E (0.31) PPARGPPARAPTPN1MCL1
SCHEMBL6215721 0.92 PPARG (0.35) PPARGPPARAPTPN1MCL1PDE10A
SCHEMBL6218384 0.90 PPARG (0.33) PPARGPPARAPTPN1
SCHEMBL6036310 0.86 PPARG (0.39) PPARGPPARAMCL1
SCHEMBL1633621 0.85 PPARG (0.48) PPARGMCL1
SCHEMBL6034568 0.85 PPARG (0.42) PPARGMCL1
SCHEMBL6217340 0.84 PPARG (0.38) PPARGPTPN1PDE10A
SCHEMBL6216367 0.83 PTPN1 (0.33) PPARGPPARAPTPN1PDE10A

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-1513817-A1 1, 2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY Takeda Pharmaceutical Company Limited (JP) 2005-03-16 EP disclosed
WO-2003099793-A9 1,2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA PHARMACEUTICAL (JP) 2005-02-10 WO disclosed
WO-2003099793-A1 1,2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-12-04 WO disclosed