SCHEMBL5679772

SCHEMBL5679772

C=CC(=O)OC(c1ccccc1CCCCCCCCC)C(C)OCC(C)OCC(C)O

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRB P10828 5/20 0.47
THRA P10827 4/20 0.47
CYSLTR2 Q9NS75 9/20 0.40
CYSLTR1 Q9Y271 9/20 0.40
LIPG Q9Y5X9 1/20 0.33
PPARA Q07869 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPT P10636 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
Ethylene Glycol SCHEMBL6297646 0.83 THRB (0.54) THRBTHRACYSLTR2CYSLTR1LIPG
SCHEMBL3296248 0.78 THRB (0.61) THRBTHRACYSLTR2CYSLTR1LIPG
SCHEMBL5679768 0.78 THRB (0.69) THRBTHRACYSLTR2CYSLTR1LIPG
SCHEMBL6467020 0.72 THRB (0.66) THRBTHRAPPARAMEN1KMT2A
SCHEMBL10780366 0.71 ADRB2 (0.53) THRBTHRALIPGPPARA
SCHEMBL19086948 0.71 ADRB2 (0.53) THRBTHRALIPGPPARA
Ethylene Glycol SCHEMBL2870806 0.71 THRB (0.61) THRBTHRACYSLTR2CYSLTR1LIPG
SCHEMBL5675242 0.69 THRB (0.50) THRBTHRACYSLTR2CYSLTR1LIPG
SCHEMBL232071 0.69 THRB (0.69) THRBTHRACYSLTR2CYSLTR1LIPG
SCHEMBL3342724 0.69 PLA2G4B (0.40) MEN1KMT2AALDH1A1

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
EP-1258518-B1 Flame-retardant curable resin composition and flame-retardant curable adhesive composition DENKI KAGAKU KOGYO KK (JP) 2006-01-04 EP disclosed
US-6893583-B2 Flame-retardant curable resin composition and flame-retardant curable adhesive composition DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2005-05-17 US disclosed
US-20020193487-A1 Flame-retardant curable resin composition and flame-retardant curable adhesive composition DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2002-12-19 US disclosed
EP-1258518-A2 Flame-retardant curable resin composition and flame-retardant curable adhesive composition DENKI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2002-11-20 EP disclosed