SCHEMBL5313645

SCHEMBL5313645

CCON=C(COc1cccc(CC(=O)O)c1)c1cccc(OCc2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.53
NR4A2 P43354 4/20 0.52
LTB4R Q15722 2/20 0.48
LTB4R2 Q9NPC1 2/20 0.48
SMPD1 P17405 1/20 0.48
SRD5A2 P31213 1/20 0.47
PLA2G4B P0C869 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
MAOA P21397 2/20 0.46
PTPN1 P18031 1/20 0.46
FFAR1 O14842 2/20 0.46

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
SCHEMBL14530611 1.00 MAOB (0.53) MAOBNR4A2LTB4RLTB4R2SMPD1
SCHEMBL5310252 0.92 FFAR1 (0.47) MAOBNR4A2SRD5A2PLA2G4BKMT2A
SCHEMBL5310255 0.92 FFAR1 (0.47) MAOBNR4A2SRD5A2PLA2G4BKMT2A
SCHEMBL5314652 0.87 PLA2G4B (0.47) LTB4RLTB4R2PLA2G4BMEN1KMT2A
SCHEMBL5314655 0.87 PLA2G4B (0.47) LTB4RLTB4R2PLA2G4BMEN1KMT2A
SCHEMBL5310840 0.85 PPARG (0.43) MAOBPLA2G4BMEN1KMT2AFFAR1
SCHEMBL5310838 0.85 PPARG (0.43) MAOBPLA2G4BMEN1KMT2AFFAR1
SCHEMBL5309894 0.83 PLA2G4B (0.50) MAOBSRD5A2PLA2G4BKMT2AFFAR1
SCHEMBL5309885 0.83 PLA2G4B (0.50) MAOBSRD5A2PLA2G4BKMT2AFFAR1
SCHEMBL5335188 0.83 FFAR1 (0.43) LTB4RLTB4R2SRD5A2PLA2G4BMEN1

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
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