Ethyl Acetate

Ethyl Acetate

SCHEMBL27263183

CCOC(C)=O.Clc1cccc(-c2ccccc2)c1Cl

nearest known ligand 0.45

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC7 O00311 1/20 0.45
▸ DBF4 Q9UBU7 1/20 0.45
▸ DHODH Q02127 1/20 0.44
▸ LMNA P02545 5/20 0.43
▸ CTSA P10619 1/20 0.42
▸ ALDH1A1 P00352 6/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ CYP2A6 P11509 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ MAPT P10636 3/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ GAA P10253 1/20 0.41

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 SCHEMBL27447758 0.99 CDC7 (0.44) CDC7DBF4DHODHLMNACTSA
Ethyl Acetate SCHEMBL27778289 0.99 CDC7 (0.44) CDC7DBF4DHODHLMNACTSA
Toluene SCHEMBL28297068 0.96 CDC7 (0.45) CDC7DBF4DHODHLMNACTSA
Acetic Acid Propyl Ester SCHEMBL27803486 0.89 LMNA (0.43) CDC7DBF4DHODHLMNACTSA
Acetic Acid Butyl Ester SCHEMBL27443716 0.86 ALDH1A1 (0.47) DHODHALDH1A1KDM4ECYP3A4TDP1
Acetic Acid SCHEMBL27690930 0.86 DHODH (0.49) DHODHLMNACTSAALDH1A1SMN1; SMN2
E1501 SCHEMBL28758534 0.86 ALDH1A1 (0.61) DHODHLMNAALDH1A1SMN1; SMN2CYP2A6
Acetic Acid Methyl Ester SCHEMBL27352057 0.84 DHODH (0.51) DHODHLMNAALDH1A1SMN1; SMN2CYP2A6
Acetic Acid SCHEMBL27614844 0.84 CYP2A6 (0.54) DHODHLMNACTSASMN1; SMN2CYP2A6
SCHEMBL28799676 0.83 DHODH (0.41) DHODHCTSAALDH1A1SMN1; SMN2CYP2A6

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 61 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107930624-A One kind catalysis burning ethyl acetate composite catalyst and its preparation method and application 西安元创化工科技股份有限公司 2018-04-20 — — CN claimed
CN-109534997-B The system and technique of the consummate ethyl acetate of rapidly extracting after a kind of pressurization lactate synthesis 兖矿鲁南化工有限公司 2019-08-30 — — CN disclosed
CN-106518619-B A kind of method of acetate preparation of ethanol through hydrogenation 中国科学院大连化学物理研究所 2019-07-02 — — CN disclosed
CN-109534997-A The system and technique of the consummate ethyl acetate of rapidly extracting after a kind of pressurization lactate synthesis 兖矿鲁南化工有限公司 2019-03-29 — — CN disclosed
CN-109394947-A A kind of preparation method using Freezing smashing technology production Qiju Dihuang Wan 河南百年康鑫药业有限公司 2019-03-01 — — CN disclosed
CN-208098060-U A kind of production of resins system 四川普思瑞新材料有限公司 2018-11-16 — — CN disclosed
CN-208098060-U A kind of production of resins system 四川普思瑞新材料有限公司 2018-11-16 — — CN disclosed
CN-108456138-A A kind of production technology of ethyl acetate 广西金茂生物化工有限公司 2018-08-28 — — CN disclosed
CN-108380219-A A kind of catalyst and its preparation method and application of ethyl acetate preparation of ethanol by hydrogenating 浙江大学 2018-08-10 — — CN disclosed
CN-108079929-A A kind of production of resins system 四川普思瑞新材料有限公司 2018-05-29 — — CN disclosed
CN-101808982-A Acetylene compound FUJIFILM CORP 2010-08-18 — — CN disclosed
CN-101735046-A Method for processing industrial effluent of acetic ether JIANGMEN HANDSOME CHEMICAL DEV 2010-06-16 — — CN disclosed
CN-201445892-U Exhaust recovery unit JIANGSU KAIYUAN ENVIRONMENTAL PROT TECHNOLOGY ENGINEERING CO LTD 2010-05-05 — — CN disclosed
CN-101665481-A Eriosema chinense isoflavone compound and extraction method and application thereof QINGLU LI 2010-03-10 — — CN disclosed
CN-101324551-A Quality control method of rupatadine fumarate GUANGDONG KANGHONG PHARMACEUTI (CN) 2008-12-17 — — CN disclosed
CN-1827581-A Process and equipment for preparing ethyl acetate and butyl acetate UNIV SOUTH CHINA TECH (CN) 2006-09-06 — — CN disclosed
CN-1090995-C A two step gold addition method for preparing a vinyl acetate catalyst HOECHEST CELANESE CORP (US) 2002-09-18 — — CN disclosed
CN-1216482-A Two-step gold-adding method for preparing vinyl acetate catalyst HOECHST CELANESE CORP (US) 1999-05-12 — — CN disclosed
CN-1023483-C Novel process for preparing dextrorotatory optical isomer of diastereomer A of (+/-) -2, 6-dimethyl-4 (M-nitrophenyl) -1, 4-dihydropyrrolidine-3, 5-dicarboxylic acid-3- (1-benzylpyrrolidin-3-yl) -5-methyl ester YAMANOUCHI PHARMA CO LTD (JP) 1994-01-12 — — CN disclosed
CN-85107590-A Production of dextrorotatory optical isomer of YM-09730 diastereomer A — 1986-07-23 — — CN disclosed
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