SCHEMBL3430359

SCHEMBL3430359

Cc1cccc(COCC(C)(C)COCc2nc(-c3ccc(F)cc3)oc2C)c1C(=O)O.Cc1oc(-c2ccc(F)cc2)nc1CI

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 13/20 0.41
PPARA Q07869 13/20 0.41
CYP2C9 P11712 1/20 0.41
KCNH2 Q12809 1/20 0.41
TP53 P04637 3/20 0.41
PPARD Q03181 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL3297768 0.96 PPARG (0.43) PPARGPPARACYP2C9KCNH2TP53
SCHEMBL3370887 0.93 PPARA (0.41) PPARGPPARACYP2C9KCNH2TP53
SCHEMBL3426842 0.90 PPARA (0.43) PPARGPPARACYP2C9KCNH2TP53
SCHEMBL3424581 0.90 PPARA (0.43) PPARGPPARACYP2C9KCNH2TP53
SCHEMBL3292836 0.88 PPARA (0.43) PPARGPPARACYP2C9KCNH2TP53
SCHEMBL3373510 0.86 KDM4E (0.49) TP53PPARDMAPTKDM4E
SCHEMBL3297707 0.85 PPARA (0.46) PPARGPPARACYP2C9KCNH2TP53
SCHEMBL3297799 0.85 PPARA (0.46) PPARGPPARACYP2C9KCNH2TP53
SCHEMBL3370847 0.82 PPARG (0.45) PPARGPPARACYP2C9KCNH2TP53
SCHEMBL3371224 0.82 PPARG (0.43) PPARGPPARACYP2C9KCNH2TP53

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