Acrylic Acid Ethyl Ester

Acrylic Acid Ethyl Ester

SCHEMBL4368399

C=CC(=O)OCC.O=C1NC(=O)C2CCC=CC12

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ALOX15 P16050 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HPGD P15428 3/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TSHR P16473 1/20 0.31
ESR2 Q92731 1/20 0.30
THRB P10828 1/20 0.30
SLC22A1 O15245 1/20 0.30

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
Acrylic Acid Ethyl Ester SCHEMBL29619669 0.80 HPGD (0.37) ALDH1A1HPGDMAPK1HSD17B10TSHR
Acrylic Acid Ethyl Ester SCHEMBL1637388 0.79 TSHR (0.38) ALDH1A1HPGDMAPK1HSD17B10TSHR
Acrylic Acid Ethyl Ester SCHEMBL4363537 0.77 MEN1 (0.32) ALDH1A1ALOX15HPGDMAPK1HSD17B10
SCHEMBL179776 0.77 BACE1 (0.33)
SCHEMBL2992065 0.77 BACE1 (0.33)
Methacrylic Acid SCHEMBL4815762 0.75 ALDH1A1 (0.33) ALDH1A1HSD17B10TSHR
SCHEMBL2471188 0.75 BACE1 (0.32)
SCHEMBL2468842 0.75 BACE1 (0.32)
SCHEMBL31741298 0.75 BACE1 (0.32)
SCHEMBL2463994 0.75 BACE1 (0.32)

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-1865035-B1 INK COMPOSITION FOR INKJET PRINTER DAINIPPON INK & CHEMICALS (JP) 2013-05-01 EP disclosed
US-8383743-B2 Ink composition for jet printer DAINIPPON INK AND CHEMICALS, INC. (JP) 2013-02-26 US disclosed
US-20090130405-A1 INK COMPOSITION FOR JET PRINTER DAINIPPON INK AND CHEMICALS, INC. (JP) 2009-05-21 US disclosed
EP-1865035-A1 INK COMPOSITION FOR INKJET PRINTER DAINIPPON INK AND CHEMICALS, INC. (JP) 2007-12-12 EP disclosed