Acrylic Acid Methyl Ester

Acrylic Acid Methyl Ester

SCHEMBL28297915

C=C(OC)C(=O)OC.C=CC(=O)OC

nearest known ligand 0.42

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Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
HCAR2 Q8TDS4 2/20 0.40
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
TSHR P16473 6/20 0.34
HPGD P15428 1/20 0.33
TGM2 P21980 1/20 0.32
TP53 P04637 2/20 0.32
HIF1A Q16665 2/20 0.32
CYP3A4 P08684 1/20 0.32
HSD17B10 Q99714 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
Acrylic Acid SCHEMBL28069338 0.84 LMNA (0.48) ALDH1A1HCAR2KEAP1NFE2L2TSHR
Acrylic Acid Methyl Ester SCHEMBL7645157 0.83 HCAR2 (0.56) ALDH1A1HCAR2KEAP1NFE2L2TSHR
Acrylic Acid Methyl Ester SCHEMBL9108 0.83
SCHEMBL1334304 0.83
Acrylic Acid Methyl Ester SCHEMBL1854813 0.83 HCAR2 (0.56) ALDH1A1HCAR2KEAP1NFE2L2TSHR
Acrylic Acid Methyl Ester SCHEMBL2936703 0.82 ALDH1A1 (0.68) ALDH1A1HCAR2KEAP1NFE2L2TSHR
Acrylic Acid Methyl Ester SCHEMBL4163868 0.82 ALDH1A1 (0.68) ALDH1A1HCAR2KEAP1NFE2L2TSHR
Acrylic Acid Methyl Ester SCHEMBL4172054 0.82 ALDH1A1 (0.68) ALDH1A1HCAR2KEAP1NFE2L2TSHR
SCHEMBL22115530 0.82 ALDH1A1 (0.37) ALDH1A1HCAR2KEAP1NFE2L2TSHR
Acrylic Acid Methyl Ester SCHEMBL4171350 0.82 ALDH1A1 (0.68) ALDH1A1HCAR2KEAP1NFE2L2TSHR

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
CN-109844586-A Curable resin composition for optical film, and method for producing same 日东电工株式会社 2019-06-04 CN disclosed