Acrylic Acid Methyl Ester

Acrylic Acid Methyl Ester

SCHEMBL7270941

C=CC(=O)OC.CCOC(CC)Oc1ccc(C=CC=Cc2ccc(O)cc2)cc1

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.43
CA1 P00915 3/20 0.43
CA2 P00918 3/20 0.43
CA7 P43166 3/20 0.43
CA9 Q16790 3/20 0.43
CA14 Q9ULX7 3/20 0.43
TYR P14679 1/20 0.43
STAT3 P40763 1/20 0.42
ABCG2 Q9UNQ0 3/20 0.39
MAOB P27338 1/20 0.39
BACE1 P56817 2/20 0.38
MIF P14174 1/20 0.37
MMP2 P08253 2/20 0.36
MMP9 P14780 2/20 0.36
MMP13 P45452 1/20 0.36
TAS1R3 Q7RTX0 2/20 0.36
TAS1R1 Q7RTX1 2/20 0.36
MMP1 P03956 1/20 0.36
MAPT P10636 2/20 0.36
P4HB P07237 1/20 0.36

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
SCHEMBL7270951 0.88 CA12 (0.38) CA12CA1CA2CA7CA9
Acrylic Acid Methyl Ester SCHEMBL7263902 0.88 CA12 (0.44) CA12CA1CA2CA7CA9
SCHEMBL4964002 0.87 APP (0.46) CA12CA1CA2CA7CA9
SCHEMBL7270957 0.86 STAT3 (0.41) CA12CA1CA2CA7CA9
SCHEMBL7265047 0.84 CA12 (0.35) CA12CA1CA2CA7CA9
SCHEMBL7263305 0.81 CA12 (0.42) CA12CA1CA2CA7CA9
Acrylic Acid Methyl Ester SCHEMBL7272022 0.80 CA12 (0.43) CA12CA1CA2CA7CA9
SCHEMBL7263890 0.79 APP (0.48) CA12CA1CA2CA7CA9
SCHEMBL7263905 0.79 STAT3 (0.37) CA12CA1CA2CA7CA9
SCHEMBL5702425 0.78 CYP2C19 (0.47) MAPTMEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6656660-B1 Resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-12-02 US disclosed
EP-1024406-A1 Resist composition WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 2000-08-02 EP disclosed