SCHEMBL3424581

SCHEMBL3424581

Cc1cccc(COCCCCOCc2nc(-c3ccc(F)cc3)oc2C)c1C(=O)O.Cc1oc(-c2ccc(F)cc2)nc1CI

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 15/20 0.43
PPARG P37231 14/20 0.43
PPARD Q03181 2/20 0.43
TP53 P04637 3/20 0.42
POLB P06746 1/20 0.41
CYP2C9 P11712 1/20 0.40
KCNH2 Q12809 1/20 0.40

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
SCHEMBL3426842 0.98 PPARA (0.43) PPARAPPARGPPARDTP53POLB
SCHEMBL3297799 0.95 PPARA (0.46) PPARAPPARGPPARDTP53POLB
SCHEMBL3297707 0.94 PPARA (0.46) PPARAPPARGPPARDTP53POLB
SCHEMBL3370847 0.93 PPARG (0.45) PPARAPPARGPPARDTP53CYP2C9
SCHEMBL3371224 0.91 PPARG (0.43) PPARAPPARGPPARDTP53POLB
SCHEMBL3430359 0.90 PPARG (0.41) PPARAPPARGPPARDTP53POLB
SCHEMBL13295227 0.88 KDM4E (0.48) PPARAPPARGPPARDTP53
SCHEMBL3317048 0.88 PPARG (0.48) PPARAPPARGPPARDTP53POLB
SCHEMBL3369918 0.88 PPARG (0.43) PPARAPPARGPPARDTP53
SCHEMBL3298881 0.86 PPARG (0.46) PPARAPPARGPPARDTP53POLB

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