Acetic Acid Butyl Ester

Acetic Acid Butyl Ester

SCHEMBL301515

CCCCOC(C)=O.CCOC(C)=O

nearest known ligand 0.86

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.86
LMNA P02545 1/20 0.67
HSD17B10 Q99714 1/20 0.67
TSHR P16473 5/20 0.54
ATM Q13315 1/20 0.52
HPGD P15428 1/20 0.48
HCAR2 Q8TDS4 1/20 0.45
NAAA Q02083 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CHRM5 P08912 2/20 0.43
CHRM1 P11229 2/20 0.43
CHRM3 P20309 2/20 0.43
PGR P06401 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
HTR1A P08908 1/20 0.43
CHRNB2 P17787 1/20 0.43
TBXA2R P21731 1/20 0.43
CHRNB4 P30926 1/20 0.43

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
Acetic Acid Butyl Ester SCHEMBL13518089 1.00 ALDH1A1 (0.86) ALDH1A1LMNAHSD17B10TSHRATM
Acetic Acid Butyl Ester SCHEMBL4160553 1.00 ALDH1A1 (0.86) ALDH1A1LMNAHSD17B10TSHRATM
Acetic Acid Butyl Ester SCHEMBL19712585 1.00 ALDH1A1 (0.86) ALDH1A1LMNAHSD17B10TSHRATM
Acetic Acid Butyl Ester SCHEMBL18262002 0.96 ALDH1A1 (0.78) ALDH1A1LMNAHSD17B10TSHRATM
Acetic Acid Pentyl Ester SCHEMBL27781076 0.96 ALDH1A1 (0.78) ALDH1A1LMNAHSD17B10TSHRATM
Acetic Acid Butyl Ester SCHEMBL28021488 0.96 ALDH1A1 (0.78) ALDH1A1LMNAHSD17B10TSHRATM
Hexyl Acetate SCHEMBL28303077 0.94 ALDH1A1 (0.75) ALDH1A1LMNAHSD17B10TSHRATM
Acetic Acid Butyl Ester SCHEMBL28047389 0.94 ALDH1A1 (0.75) ALDH1A1LMNAHSD17B10TSHRATM
Acetic Acid Butyl Ester SCHEMBL1898851 0.94 ALDH1A1 (0.75) ALDH1A1LMNAHSD17B10TSHRATM
Acetic Acid Butyl Ester SCHEMBL14935657 0.94 ALDH1A1 (0.75) ALDH1A1LMNAHSD17B10TSHRATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110681552-B Preparation method of abrasion-resistant super-hydrophobic coating 三峡大学 2021-10-01 CN claimed
CN-112876684-A Micron-level high-crosslinking-degree organic silicon polymer microspheres with controllable particle sizes and preparation method thereof 新辉(中国)新材料有限公司 2021-06-01 CN claimed
CN-108822182-B Preparation method of rhizoma paridis saponin H and application thereof in treating gastroenteritis 广西壮族自治区药用植物园 2021-05-11 CN claimed
US-20200108353-A1 GRAPHENE OXIDE MEMBRANES FOR FILTERING ORGANIC SOLUTIONS THE UNIVERSITY OF MANCHESTER (GB) 2020-04-09 US claimed
CN-110965101-A Magnetic suspension constant-temperature cooling single tin oxide coloring method 安徽科蓝特铝业有限公司 2020-04-07 CN claimed
EP-3600632-A2 MEMBRANES FOR FILTERING ORGANIC SOLUTIONS The University of Manchester (GB) 2020-02-05 EP claimed
WO-2018178706-A9 GRAPHENE OXIDE MEMBRANES FOR FILTERING ORGANIC SOLUTIONS THE UNIVERSITY OF MANCHESTER (GB) 2018-12-13 WO claimed
CN-108840845-A The method of Xanthatin is extracted from Siberian cocklebur 广西壮族自治区药用植物园 2018-11-20 CN claimed
CN-108822182-A The preparation method of chonglou saponin H and its application in treatment gastroenteritis 广西壮族自治区药用植物园 2018-11-16 CN claimed
CN-108578495-A Radix Mussaendae extract and its preparation and the application for treating enteritis 广西中医药大学 2018-09-28 CN claimed
CN-105004799-B A kind of detection method of content of 8 kinds of fixedness compositions in dragon and tiger rentan plant medicine blood plasma 上海中华药业有限公司 2017-07-18 CN claimed
CN-106317373-A Isocyanate prepolymer and preparation method thereof 万华化学(北京)有限公司 2017-01-11 CN claimed
WO-2014118802-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF CLOPIDOGREL BISULFATE FORM-I PHARMAZELL GMBH (DE) 2014-08-07 WO claimed
EP-1780181-A1 A paste composition, and a green sheet, for forming a dielectric layer, and a method for forming a dielectric layer of plasma display panel LG Electronics Inc. (KR) 2007-05-02 EP claimed
US-20070093590-A1 Paste composition, and a green sheet, for forming a dielectric layer, and a method for forming a dielectric layer of plasma display panel LG ELECTRONICS INC. (KR) 2007-04-26 US claimed
JP-2005523252-A 2005-08-04 JP claimed
US-20050084553-A1 Composition containing moutan root bark extract as active ingredient MICRO SCIENCE TECH CO., LTD. (KR) 2005-04-21 US claimed
WO-2003061554-A2 COMPOSITION CONTAINING MOUTAN ROOT BARK EXTRACT AS ACTIVE INGREDIENT MICRO SCIENCE TECH CO., LTD (KR) 2003-07-31 WO claimed
US-4766005-A NONAQUEOUS SOLVENT AND ALKALIZING AGENT OPI PRODUCTS, INC. (US) 1988-08-23 US claimed
US-4229227-A MODIFIED MONTMORILLONITE, NITROCELLULOSE, AND A POLYETHER, OXIDE ADDUCT OR DICARBOXYLIC ESTER AND SOLVENTS SHISEIDO CO., LTD. (JP) 1980-10-21 US claimed