SCHEMBL3369876

SCHEMBL3369876

Cc1cccc(COCC(C)(C)COCc2coc(-c3ccc(F)cc3)n2)c1C(=O)O.Fc1ccc(-c2nc(CI)co2)cc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 7/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
FFAR1 O14842 2/20 0.37
PPARG P37231 6/20 0.35
HPGD P15428 1/20 0.35
KLK1 P06870 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34

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
SCHEMBL3294431 0.96 PPARA (0.44) PPARALMNAGAATSHRKMT2A
SCHEMBL4827344 0.81 LMNA (0.41) PPARALMNAGAATSHRKMT2A
SCHEMBL3430359 0.81 PPARG (0.41) PPARAPPARG
SCHEMBL14106717 0.80 HPGD (0.46) PPARALMNAGAATSHRKMT2A
SCHEMBL4835194 0.80 HPGD (0.46) PPARALMNAGAATSHRKMT2A
SCHEMBL3297768 0.79 PPARG (0.43) PPARAPPARG
SCHEMBL4829988 0.79 HPGD (0.41) PPARALMNAGAATSHRKMT2A
SCHEMBL14106718 0.79 HPGD (0.42) PPARALMNAGAATSHRKMT2A
SCHEMBL4452526 0.78 PPARA (0.57) PPARALMNAFFAR1PPARG
SCHEMBL4834582 0.78 HPGD (0.44) PPARALMNAGAATSHRKMT2A

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 1 patent. 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