Ethyl Acetate

Ethyl Acetate

SCHEMBL28079338

C=C.C=COC(C)=O.CCOC(C)=O

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.61
LMNA P02545 1/20 0.61
HSD17B10 Q99714 1/20 0.61
TSHR P16473 3/20 0.40
GLO1 Q04760 1/20 0.38
ALOX15 P16050 1/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
SOAT1 P35610 1/20 0.36
HCAR2 Q8TDS4 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
TRPA1 O75762 1/20 0.33
HPGD P15428 1/20 0.32
THRB P10828 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
Ethyl Acetate SCHEMBL10332176 0.98 ALDH1A1 (0.64) ALDH1A1LMNAHSD17B10TSHRGLO1
Ethyl Acetate SCHEMBL1578534 0.94 ALDH1A1 (0.58) ALDH1A1LMNAHSD17B10TSHRGLO1
Urethane SCHEMBL8675165 0.86 ALOX15 (0.58) ALDH1A1LMNAHSD17B10TSHRGLO1
Alcohol SCHEMBL1684991 0.84 ALDH1A1 (0.36) ALDH1A1LMNAHSD17B10TSHRHPGD
Acrylic Acid Ethyl Ester SCHEMBL8060405 0.83 TSHR (0.47) ALDH1A1LMNAHSD17B10TSHRGLO1
Urethane SCHEMBL155269 0.83 ALOX15 (0.60) ALDH1A1LMNAHSD17B10TSHRGLO1
Bicarbonate SCHEMBL28328745 0.83 ALDH1A1 (0.52) ALDH1A1LMNAHSD17B10TSHRGLO1
Diethyl Maleate SCHEMBL11796378 0.83 HCAR2 (0.55) ALDH1A1LMNAHSD17B10GLO1HCAR2
Ethylene SCHEMBL10382764 0.83 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10TSHR
Ethyl Acetate SCHEMBL24482 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104151697-B A kind of processing technology of PP fretting map lightweight plate 安徽恒森新材料有限公司 2016-08-24 CN disclosed