Ethyl Acetate

Ethyl Acetate

SCHEMBL28844994

CCOC(C)=O.S=C(S)S

nearest known ligand 0.74

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.74
LMNA P02545 1/20 0.74
HSD17B10 Q99714 1/20 0.74
CA12 O43570 5/20 0.48
CA1 P00915 5/20 0.48
CA2 P00918 5/20 0.48
CA9 Q16790 5/20 0.48
TSHR P16473 1/20 0.46
ALOX15 P16050 1/20 0.42
MGAM O43451 1/20 0.42
GAA P10253 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
SOAT1 P35610 1/20 0.42
CYP2D6 P10635 1/20 0.40
TRPA1 O75762 1/20 0.39
GLO1 Q04760 1/20 0.38
PGR P06401 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36

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 SCHEMBL28294655 0.90 ALDH1A1 (0.67) ALDH1A1LMNAHSD17B10CA12CA1
Ethyl Acetate SCHEMBL6029488 0.86
Ethyl Acetate SCHEMBL28457765 0.86 ALDH1A1 (1.00) ALDH1A1LMNAHSD17B10CA12CA1
Ethyl Acetate SCHEMBL1331990 0.86
Ethyl Acetate SCHEMBL1330811 0.86
Ethyl Acetate SCHEMBL30152067 0.86
Ethyl Acetate SCHEMBL28615209 0.86 ALDH1A1 (1.00) ALDH1A1LMNAHSD17B10CA12CA1
Ethyl Acetate SCHEMBL1331901 0.86
Ethyl Acetate SCHEMBL70316 0.86 ALDH1A1 (1.00) ALDH1A1LMNAHSD17B10CA12CA1
Ethyl Acetate SCHEMBL8506185 0.86 ALDH1A1 (1.00) ALDH1A1LMNAHSD17B10CA12CA1

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
CN-114933576-B Furfuryl sodium trithiocarbonate and its ester derivative as copper slag high temperature floatation collector 福州大学 2023-11-07 CN disclosed
CN-114933576-A Furfuryl sodium trithiocarbonate and ester derivatives thereof used as copper slag high-temperature flotation collector 福州大学 2022-08-23 CN disclosed