Acrylic Acid Methyl Ester

Acrylic Acid Methyl Ester

SCHEMBL9818375

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

nearest known ligand 0.37

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Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.37
KEAP1 Q14145 1/20 0.37
NFE2L2 Q16236 1/20 0.37
TSHR P16473 7/20 0.32
HPGD P15428 1/20 0.31
ALDH1A1 P00352 4/20 0.30
TP53 P04637 2/20 0.30
HIF1A Q16665 2/20 0.30
CYP3A4 P08684 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL28166859 0.89 TSHR (0.36) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL6567096 0.80
Acrylic Acid Methyl Ester SCHEMBL1854813 0.79 HCAR2 (0.56) HCAR2KEAP1NFE2L2TSHRHPGD
Acrylic Acid Methyl Ester SCHEMBL9108 0.79
Acrylic Acid Methyl Ester SCHEMBL7645157 0.79 HCAR2 (0.56) HCAR2KEAP1NFE2L2TSHRHPGD
Acrylic Acid Methyl Ester SCHEMBL28463059 0.78 HCAR2 (0.40) HCAR2KEAP1NFE2L2TSHRHPGD
Acrylic Acid Methyl Ester SCHEMBL1138061 0.78 HCAR2 (0.40) HCAR2KEAP1NFE2L2TSHRHPGD
SCHEMBL28171450 0.78 TSHR (0.41) HCAR2KEAP1NFE2L2TSHRHPGD
SCHEMBL28163786 0.78 TSHR (0.41) HCAR2KEAP1NFE2L2TSHRHPGD
Methane SCHEMBL10769987 0.78 TSHR (0.41) HCAR2KEAP1NFE2L2TSHRHPGD

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
US-5043241-A Disperssion of copolymer resin grains; storage stability FUJI PHOTO FILM CO., LTD. (JP) 1991-08-27 US disclosed