SCHEMBL5315690

SCHEMBL5315690

CON=C(COc1cccc(CC(=O)O)c1)c1cccc(Oc2ccccc2)c1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.49
PLA2G4B P0C869 1/20 0.46
SRD5A2 P31213 2/20 0.44
AKR1C3 P42330 1/20 0.44
MAOB P27338 1/20 0.43
PTGDR2 Q9Y5Y4 3/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
NR4A2 P43354 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
PPARD Q03181 1/20 0.42
FFAR4 Q5NUL3 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL5315685 1.00 FFAR1 (0.49) FFAR1PLA2G4BSRD5A2AKR1C3MAOB
SCHEMBL5314705 0.90 LMNA (0.47) FFAR1SRD5A2AKR1C3PTGDR2KDM4E
SCHEMBL5314708 0.90 LMNA (0.47) FFAR1SRD5A2AKR1C3PTGDR2KDM4E
SCHEMBL5315184 0.89 FFAR1 (0.44) FFAR1PLA2G4BSRD5A2AKR1C3KDM4E
SCHEMBL5315193 0.89 FFAR1 (0.44) FFAR1PLA2G4BSRD5A2AKR1C3KDM4E
SCHEMBL5310255 0.89 FFAR1 (0.47) FFAR1PLA2G4BSRD5A2AKR1C3MAOB
SCHEMBL5310252 0.89 FFAR1 (0.47) FFAR1PLA2G4BSRD5A2AKR1C3MAOB
SCHEMBL5313039 0.89 PPARG (0.44) FFAR1PLA2G4BMAOBPTGDR2KMT2A
SCHEMBL5313036 0.89 PPARG (0.44) FFAR1PLA2G4BMAOBPTGDR2KMT2A
SCHEMBL5309885 0.87 PLA2G4B (0.50) FFAR1PLA2G4BSRD5A2AKR1C3MAOB

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 claimed
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