SCHEMBL5314652

SCHEMBL5314652

CCO/N=C(\COc1cccc(CC(=O)O)c1)c1ccc2ccccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G4B P0C869 2/20 0.47
PTPN7 P35236 1/20 0.43
PPARD Q03181 2/20 0.43
PPARG P37231 4/20 0.42
PPARA Q07869 3/20 0.42
POLB P06746 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NCOA2 Q15596 1/20 0.42
NCOA1 Q15788 1/20 0.42
NCOA3 Q9Y6Q9 1/20 0.42
NR1H4 Q96RI1 2/20 0.41
MRGPRX4 Q96LA9 1/20 0.40
ALOX5 P09917 1/20 0.39
NPC1 O15118 1/20 0.39
CASP3 P42574 1/20 0.39
RAB9A P51151 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39

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
SCHEMBL5314655 1.00 PLA2G4B (0.47) PLA2G4BPTPN7PPARDPPARGPPARA
SCHEMBL5331241 0.92 PLA2G4B (0.50) PLA2G4BPTPN7PPARDPPARGPPARA
SCHEMBL5331237 0.92 PLA2G4B (0.50) PLA2G4BPTPN7PPARDPPARGPPARA
SCHEMBL5310046 0.89 PLA2G4B (0.46) PLA2G4BPTPN7PPARDPPARGPPARA
SCHEMBL5310042 0.89 PLA2G4B (0.46) PLA2G4BPTPN7PPARDPPARGPPARA
SCHEMBL5310255 0.87 FFAR1 (0.47) PLA2G4BPPARDPPARGPPARAKMT2A
SCHEMBL5313645 0.87 MAOB (0.53) PLA2G4BMEN1KMT2ALTB4RLTB4R2
SCHEMBL5310252 0.87 FFAR1 (0.47) PLA2G4BPPARDPPARGPPARAKMT2A
SCHEMBL14530611 0.87 MAOB (0.53) PLA2G4BMEN1KMT2ALTB4RLTB4R2
SCHEMBL5426947 0.84 PPARG (0.46) PLA2G4BPPARDPPARGPPARANR1H4

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
WO-2007058504-A1 NOVEL COMPOUNDS AS AGONIST FOR PPAR GAMMA AND PPAR ALPHA, METHOD FOR PREPARATION OF THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES, LTD. (KR) 2007-05-24 WO disclosed
WO-2007058504-A1 NOVEL COMPOUNDS AS AGONIST FOR PPAR GAMMA AND PPAR ALPHA, METHOD FOR PREPARATION OF THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES, LTD. (KR) 2007-05-24 WO disclosed