Acrylic Acid Ethyl Ester

Acrylic Acid Ethyl Ester

SCHEMBL10600284

C=C(C)C(=O)O.C=C(C)C(=O)OC.C=C(C)C(=O)OCc1ccccc1.C=CC(=O)OCC

nearest known ligand 0.42

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Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
MAPT P10636 2/20 0.40
CTSL P07711 3/20 0.39
TGM2 P21980 1/20 0.39
HCAR2 Q8TDS4 1/20 0.39
NR1H4 Q96RI1 1/20 0.39
MBOAT4 Q96T53 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
FKBP1A P62942 1/20 0.38
LMNA P02545 1/20 0.37
THRB P10828 1/20 0.37
CTSB P07858 2/20 0.37

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 SCHEMBL3690840 0.93 ALDH1A1 (0.49) ALDH1A1MAPTCTSLTGM2HCAR2
Acrylic Acid Methyl Ester SCHEMBL8945752 0.89 ALDH1A1 (0.47) ALDH1A1CTSLTGM2HCAR2NPC1
Methacrylic Acid SCHEMBL10598289 0.89 ALDH1A1 (0.47) ALDH1A1TGM2HCAR2NPC1RAB9A
SCHEMBL628109 0.89 ALDH1A1 (0.50) ALDH1A1TGM2HCAR2NPC1RAB9A
Acrylic Acid Ethyl Ester SCHEMBL28277476 0.88 ALDH1A1 (0.44) ALDH1A1MAPTCTSLTGM2HCAR2
SCHEMBL28246245 0.87 ALDH1A1 (0.49) ALDH1A1MAPTTGM2HCAR2NR1H4
Acrylic Acid Ethyl Ester SCHEMBL28305770 0.87 THRB (0.40) ALDH1A1MAPTCTSLTGM2HCAR2
Acrylic Acid Ethyl Ester SCHEMBL10601689 0.87 ALDH1A1 (0.36) ALDH1A1MAPTCTSLTGM2HCAR2
Methacrylic Acid SCHEMBL3650409 0.87 ALDH1A1 (0.54) ALDH1A1HCAR2NPC1RAB9AFKBP1A
Methacrylic Acid SCHEMBL28171879 0.86 HCAR2 (0.50) ALDH1A1TGM2HCAR2LMNATHRB

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-0196561-B1 PHOTOSENSITIVE LITHOGRAPHIC PRINTING PLATE NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-06-14 EP claimed
EP-0196561-A1 Photosensitive lithographic printing plate NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1986-10-08 EP disclosed