Ethyl Acetate

Ethyl Acetate

SCHEMBL9507364

CCOC(C)=O.CCOC(C)=O.c1ccccc1

nearest known ligand 0.82

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.82
LMNA P02545 1/20 0.82
HSD17B10 Q99714 1/20 0.82
TSHR P16473 2/20 0.50
GAA P10253 2/20 0.46
ALOX15 P16050 1/20 0.46
MGAM O43451 1/20 0.46
SI P14410 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46
SOAT1 P35610 1/20 0.46
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
HCAR2 Q8TDS4 1/20 0.42
PIN1 Q13526 1/20 0.42

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
Ethyl Acetate SCHEMBL11511384 1.00 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL10991977 1.00 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL508537 1.00 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL8935437 1.00 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL6543826 1.00 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL329089 1.00 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL9665914 1.00 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL10771774 1.00 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL9495 1.00 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL7455458 1.00 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA

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
CN-1680563-A Amino alcohol derivatives SANKYO CO (JP) 2005-10-12 CN disclosed
EP-0411624-B1 SACCHARIDE DERIVATIVES OF PROTOCATECHUALDEHYDE KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 1993-07-07 EP disclosed
US-5120835-A Antiinflammatory agents KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 1992-06-09 US disclosed
CN-1049346-A The carbohydrate derivative of rancinamycin IV KUREHA CHEMICAL IND CO LTD (JP) 1991-02-20 CN disclosed
EP-0411624-A2 Saccharide derivatives of protocatechualdehyde KUREHA CHEMICAL INDUSTRY CO., LTD. (JP) 1991-02-06 EP disclosed
US-4529722-A A 7-ureidoacetamido-7a-methoxy-3-(1-(2-hydroxyethyl)-1H-tetrazol-5 -yl)thiomethyl-1-dethia-1-oxa-3-cephem carboxylic acid derivative SHIONOGI & CO., LTD. (JP) 1985-07-16 US disclosed
EP-0111421-A1 Oxacephalosporin derivatives, their preparation and use SHIONOGI & CO., LTD. (JP) 1984-06-20 EP disclosed