Acrylic Acid Ethyl Ester

Acrylic Acid Ethyl Ester

SCHEMBL7637636

C=CC(=O)OCC.O=C1CCCCCO1.O=C1CCCCCO1

nearest known ligand 0.47

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Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.47
CA9 Q16790 1/20 0.47
TSHR P16473 7/20 0.37
HPGD P15428 3/20 0.37
ALDH1A1 P00352 5/20 0.36
CYP3A4 P08684 1/20 0.36
ATM Q13315 1/20 0.33
TP53 P04637 2/20 0.33
HIF1A Q16665 2/20 0.33
HSD17B10 Q99714 2/20 0.33
THRB P10828 2/20 0.32
HCAR2 Q8TDS4 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
PGR P06401 2/20 0.31
KDM4E B2RXH2 1/20 0.31
RECQL P46063 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 SCHEMBL27769537 1.00 CA1 (0.47) CA1CA9TSHRHPGDALDH1A1
Acrylic Acid Ethyl Ester SCHEMBL27877556 0.91 TSHR (0.54) CA1CA9TSHRHPGDALDH1A1
SCHEMBL698482 0.86 TSHR (0.58) CA1CA9TSHRHPGDALDH1A1
SCHEMBL28181656 0.86 CA1 (0.44) CA1CA9THRB
SCHEMBL28088641 0.85 TSHR (0.45) CA1CA9TSHRHPGDALDH1A1
SCHEMBL9732335 0.84 CA1 (0.46) CA1CA9HPGDALDH1A1HSD17B10
SCHEMBL2561776 0.84 TSHR (0.54) CA1CA9TSHRHPGDALDH1A1
SCHEMBL28402764 0.84 TSHR (0.54) CA1CA9TSHRHPGDALDH1A1
SCHEMBL28068236 0.83 CA1 (0.42) CA1CA9TSHRHPGDALDH1A1
Urethane SCHEMBL8911194 0.83 CA1 (0.42) CA1CA9HPGDALDH1A1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1185569-A1 PROCESS FOR PREPARING UNIFORMLY CONSISTENT RADIATION-CURABLE COMPOSITIONS DSM N.V. (NL) 2002-03-13 EP disclosed
US-6350790-B1 Process for preparing uniformly consistent radiation-curable compositions DSM N.V. (NL) 2002-02-26 US disclosed
WO-2000069941-A1 PROCESS FOR PREPARING UNIFORMLY CONSISTENT RADIATION-CURABLE COMPOSITIONS DSM N.V. (NL) 2000-11-23 WO disclosed