SCHEMBL6364876

SCHEMBL6364876

CCCC(C)(Oc1cccc(OCCCc2c[nH]nc2OCC)c1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLA2G4B P0C869 5/20 0.39
PPARG P37231 4/20 0.39
PPARA Q07869 3/20 0.39
PPARD Q03181 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDM4E B2RXH2 2/20 0.37
KMT2A Q03164 1/20 0.37
CYP4F2 P78329 2/20 0.36
CYP4A11 Q02928 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
SCHEMBL6275303 0.98 PPARA (0.39) PLA2G4BPPARGPPARAPPARDLMNA
SCHEMBL6035100 0.82 PPARA (0.50) PPARGPPARAPPARDLMNAMAPK1
SCHEMBL6035744 0.82 PPARA (0.52) PPARGPPARAPPARDLMNAMAPK1
SCHEMBL6281639 0.78 ALDH1A1 (0.41) PPARGPPARAPPARDLMNAMAPK1
SCHEMBL82055 0.68 PPARG (0.53) PPARGPPARAL3MBTL1KMT2A
SCHEMBL8935937 0.68 PPARG (0.53) PPARGPPARAL3MBTL1KMT2A
SCHEMBL2421443 0.68 TSHR (0.47) PPARGPPARAKMT2A
SCHEMBL16753742 0.68 PPARA (0.44) PPARGPPARALMNAMAPK1L3MBTL1
SCHEMBL15545821 0.68 PPARG (0.44) PPARGPPARAKMT2A
SCHEMBL3846291 0.68 PLA2G4B (0.40) PLA2G4BPPARGPPARAKMT2A

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