SCHEMBL5951005

SCHEMBL5951005

CCCCCC(OC(=O)CCCCC(=O)O)OC(=O)c1cccc(C(=O)O)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 2/20 0.45
PLA2G4B P0C869 2/20 0.40
FFAR4 Q5NUL3 1/20 0.40
FFAR1 O14842 1/20 0.40
ALDH1A1 P00352 1/20 0.39
PTPN11 Q06124 1/20 0.39
KMT2A Q03164 1/20 0.39
NR1H4 Q96RI1 2/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38

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
SCHEMBL11104926 0.93 LTB4R (0.43) LTB4RPLA2G4BFFAR4FFAR1ALDH1A1
Adipic Acid SCHEMBL8967488 0.86 LTB4R (0.47) LTB4RPLA2G4BFFAR4FFAR1ALDH1A1
SCHEMBL4596010 0.84 ALDH1A1 (0.40) FFAR4FFAR1ALDH1A1KMT2APPARG
SCHEMBL5378258 0.83 LTB4R (0.44) LTB4RPLA2G4BFFAR4FFAR1PTPN11
SCHEMBL7737371 0.82 ALDH1A1 (0.40) PLA2G4BFFAR4FFAR1ALDH1A1KMT2A
Isophthalic Acid SCHEMBL735784 0.81 AKR1B1 (0.57) LTB4RFFAR4FFAR1ALDH1A1KMT2A
Isophthalic Acid SCHEMBL5951008 0.80 FFAR4 (0.51) LTB4RFFAR4FFAR1ALDH1A1KMT2A
SCHEMBL5366439 0.79 PNLIP (0.50) LTB4RPLA2G4BALDH1A1PTPN11KMT2A
SCHEMBL15903015 0.79 ALDH1A1 (0.48) ALDH1A1KMT2A
SCHEMBL5371926 0.79 PNLIP (0.50) LTB4RPLA2G4BALDH1A1PTPN11KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060154082-A1 Flexible radiation curable compositions SURFACE SPECIALTIES, S.A. (BE) 2006-07-13 US disclosed
EP-1592726-A1 FLEXIBLE RADIATION CURABLE COMPOSITIONS CYTEC SURFACE SPECIALTIES, S.A. (BE) 2005-11-09 EP disclosed
WO-2004067599-A1 FLEXIBLE RADIATION CURABLE COMPOSITIONS SURFACE SPECIALTIES, S.A. (BE) 2004-08-12 WO disclosed
US-20040152799-A1 Flexible radiation curable compositions SURFACE SPECIALTIES, S.A. (BE) 2004-08-05 US disclosed