Acrylic Acid Ethyl Ester

Acrylic Acid Ethyl Ester

SCHEMBL13276142

C=C(C)C(=O)OCCO.C=CC#N.C=CC(=O)O.C=CC(=O)OCC.C=CC(=O)OCCCC

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.49
HPGD P15428 1/20 0.49
HCAR2 Q8TDS4 4/20 0.38
ALDH1A1 P00352 6/20 0.36
CYP3A4 P08684 1/20 0.36
THRB P10828 2/20 0.36
ATM Q13315 1/20 0.35
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
HSD17B10 Q99714 1/20 0.31

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 SCHEMBL13276202 0.96 TSHR (0.49) TSHRHPGDHCAR2ALDH1A1CYP3A4
Acrylonitrile SCHEMBL8964274 0.93 TSHR (0.56) TSHRHPGDHCAR2ALDH1A1CYP3A4
Acrylic Acid Ethyl Ester SCHEMBL11968708 0.92 TSHR (0.58) TSHRHPGDHCAR2ALDH1A1CYP3A4
Acrylic Acid SCHEMBL11239194 0.89 TSHR (0.61) TSHRHPGDHCAR2ALDH1A1CYP3A4
Acrylonitrile SCHEMBL27884426 0.88 TSHR (0.59) TSHRHPGDHCAR2ALDH1A1CYP3A4
SCHEMBL16102616 0.87 TSHR (0.61) TSHRHPGDHCAR2ALDH1A1CYP3A4
Acrylic Acid Ethyl Ester SCHEMBL27774266 0.86 TSHR (0.59) TSHRHPGDHCAR2ALDH1A1CYP3A4
SCHEMBL5437346 0.86 TSHR (0.67) TSHRHPGDHCAR2ALDH1A1CYP3A4
SCHEMBL10905162 0.86 TSHR (0.67) TSHRHPGDHCAR2ALDH1A1CYP3A4
SCHEMBL10601730 0.86 TSHR (0.67) TSHRHPGDHCAR2ALDH1A1CYP3A4

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
EP-2519088-A1 CONDUCTIVE CONNECTION MATERIAL, ELECTRONIC COMPONENT PRODUCING METHOD, AND ELECTRONIC MEMBER AND ELECTRONIC COMPONENT WITH CONDUCTIVE CONNECTION MATERIAL Sumitomo Bakelite Co., Ltd. (JP) 2012-10-31 EP disclosed
US-20120261174-A1 CONDUCTIVE CONNECTING MATERIAL, METHOD FOR PRODUCING ELECTRONIC COMPONENT, ELECTRONIC MEMBER WITH CONDUCTIVE CONNECTING MATERIAL AND ELECTRONIC COMPONENT SUMITOMO BAKELITE CO., LTD. (JP) 2012-10-18 US disclosed