SCHEMBL3369880

SCHEMBL3369880

CC(C)c1oc(-c2ccc3ccccc3c2)nc1CI.Cc1cccc(COCCCOCc2nc(-c3ccc4ccccc4c3)oc2C(C)C)c1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.39
PPARA Q07869 10/20 0.39
UTRN P46939 1/20 0.35
ANO1 Q5XXA6 4/20 0.34
PTGER4 P35408 1/20 0.34
PPARD Q03181 2/20 0.34
SLC26A4 O43511 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL3294403 0.96 PPARG (0.41) PPARGPPARAUTRNANO1PTGER4
SCHEMBL3370894 0.92 PPARG (0.36) PPARGPPARAPTGER4PPARDALDH1A1
SCHEMBL3295913 0.88 PPARG (0.39) PPARGPPARAPTGER4PPARDSLC26A4
SCHEMBL3372796 0.88 PPARA (0.43) PPARGPPARAPPARD
SCHEMBL3291378 0.84 PPARG (0.41) PPARGPPARAUTRNANO1PPARD
SCHEMBL3291234 0.83 PPARA (0.46) PPARGPPARAPPARD
SCHEMBL3297680 0.82 PPARG (0.42) PPARGPPARAPPARDMEN1ALDH1A1
SCHEMBL3293620 0.81 PPARG (0.42) PPARGPPARAPPARDMEN1ALDH1A1
SCHEMBL3369918 0.80 PPARG (0.43) PPARGPPARAPPARD
SCHEMBL3373753 0.79 PPARG (0.38) PPARGPPARAANO1PPARDL3MBTL1

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-1902039-B1 6-OXAZOL-4-YLMETHOXY-ALKOXYMETHYL SUBSTITUTED BENZOIC ACID DERIVATIVES FORMING PPAR LIGANDS, METHODS FOR PRODUCTION AND THE USE THEREOF IN THE FORM OF DRUGS SANOFI AVENTIS (FR) 2010-10-13 EP disclosed
EP-1902039-A1 6-OXAZOL-4-YLMETHOXY-ALKOXYMETHYL SUBSTITUTED BENZOIC ACID DERIVATIVES FORMING PPAR LIGANDS, METHODS FOR PRODUCTION AND THE USE THEREOF IN THE FORM OF DRUGS Sanofi-Aventis (FR) 2008-03-26 EP disclosed
WO-2007000235-A1 6-OXAZOL-4-YLMETHOXY-ALKOXYMETHYL SUBSTITUTED BENZOIC ACID DERIVATIVES FORMING PPAR LIGANDS, METHODS FOR PRODUCTION AND THE USE THEREOF IN THE FORM OF DRUGS SANOFI-AVENTIS (DE) 2007-01-04 WO disclosed