Acrylic Acid Methyl Ester

Acrylic Acid Methyl Ester

SCHEMBL6944453

C=CC(=O)OC.CC(=O)OC1=CCC1

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.32
PTGS1 P23219 1/20 0.31
KEAP1 Q14145 1/20 0.30
NFE2L2 Q16236 1/20 0.30
HCAR2 Q8TDS4 1/20 0.30
PTPN1 P18031 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
SCHEMBL10478097 0.84 ALDH1A1 (0.37) PTGS1
Acrylic Acid SCHEMBL8775383 0.84 LMNA (0.37) PTGS1
Acrylic Acid Ethyl Ester SCHEMBL5031298 0.83 TSHR (0.38) THRBHCAR2
Vinyl Chloride SCHEMBL9861450 0.82 GLA (0.32) PTGS1
SCHEMBL8168840 0.82 GLA (0.32) PTGS1
Formaldehyde SCHEMBL18112525 0.82 LMNA (0.35) PTGS1PTPN1
SCHEMBL2533106 0.82 LMNA (0.38) PTGS1
SCHEMBL25113 0.82
SCHEMBL8060078 0.81 CYP3A4 (0.35) THRBPTGS1
SCHEMBL10488506 0.80 TSHR (0.54) THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160270393-A1 INSECT REPELLENT COMPOSITIONS AND METHODS OF USE UNIV WAGENINGEN (NL) 2016-09-22 US disclosed
EP-3065542-A1 INSECT REPELLENT COMPOSITIONS AND METHODS OF USE Wageningen Universiteit (NL) 2016-09-14 EP disclosed
WO-2015063238-A1 INSECT REPELLENT COMPOSITIONS AND METHODS OF USE WAGENINGEN UNIVERSITEIT (NL) 2015-05-07 WO disclosed
US-6562359-B2 Hyssop oil, an essential oil of a plant hyssop (Hyssopus officinalis L.); insect repellent that works on skin or can be sprayed around the house SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2003-05-13 US disclosed
EP-0888716-B1 Mosquitoes repellent and mosquitoes repelling methods SUMITOMO CHEMICAL CO (JP) 2003-03-12 EP disclosed
US-20020006424-A1 PEST REPELLENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-01-17 US disclosed
EP-0888716-A1 Pest repellent and pest repelling methods SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-01-07 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160270393-A1 INSECT REPELLENT COMPOSITIONS AND METHODS OF USE DBNL, DLK1, DAGLA THRB 2415/4885PTGS1 1846/4885KEAP1 99/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.