Acetic Acid Isobutyl Ester

Acetic Acid Isobutyl Ester

SCHEMBL472049

CC(=O)OCC(C)C.CCOCC.OCCOCCO

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.47
ALDH1A1 P00352 5/20 0.47
LMNA P02545 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAPK1 P28482 1/20 0.36
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
THRB P10828 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
ALOX15 P16050 1/20 0.34
HTT P42858 1/20 0.33
MAPT P10636 1/20 0.33
PRKCA P17252 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32

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
Diethylene Glycol Monoethyl Ether SCHEMBL472050 0.95 TSHR (0.55) TSHRALDH1A1LMNAHSD17B10MAPK1
Acetic Acid Isobutyl Ester SCHEMBL28269264 0.95 TSHR (0.53) TSHRALDH1A1LMNAHSD17B10MAPK1
Acetic Acid Isobutyl Ester SCHEMBL27970283 0.93 TSHR (0.45) TSHRALDH1A1LMNAHSD17B10MAPK1
Acetic Acid Isobutyl Ester SCHEMBL2379796 0.91 ALDH1A1 (0.47) TSHRALDH1A1LMNAHSD17B10THRB
Acetic Acid Isobutyl Ester SCHEMBL5698773 0.89 ALDH1A1 (0.52) TSHRALDH1A1LMNAHSD17B10THRB
Acetic Acid Isobutyl Ester SCHEMBL700649 0.84 ALDH1A1 (0.44) TSHRALDH1A1LMNAHSD17B10TDP1
Acetic Acid Isobutyl Ester SCHEMBL1821136 0.83 TSHR (0.46) TSHRALDH1A1LMNAHSD17B10THRB
Di(Hydroxyethyl)Ether SCHEMBL181560 0.83 ALDH1A1 (0.61) TSHRALDH1A1LMNAHSD17B10MAPK1
Ether SCHEMBL1401416 0.81 ALDH1A1 (0.72) TSHRALDH1A1LMNAHSD17B10MAPK1
Ether SCHEMBL243266 0.81 ALDH1A1 (0.72) TSHRALDH1A1LMNAHSD17B10MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2776615-A1 SOLVENT-BORNE PRODUCTS CONTAININGS SHORT-CUT MICROFIBERS Eastman Chemical Company (US) 2014-09-17 EP claimed
US-20130123409-A1 SOLVENT-BORNE PRODUCTS CONTAINING SHORT-CUT MICROFIBERS EASTMAN CHEMICAL COMPANY (US) 2013-05-16 US claimed
WO-2013070997-A1 SOLVENT-BORNE PRODUCTS CONTAININGS SHORT-CUT MICROFIBERS EASTMAN CHEMICAL COMPANY (US) 2013-05-16 WO claimed
WO-2023238286-A1 PHOTOSENSITIVE RESIN COMPOSITION ラサ工業株式会社 2023-12-14 WO disclosed
CN-117075425-A Polysiloxane composition, composition for forming film, laminate, touch panel, and method for forming cured film 阪田油墨株式会社 2023-11-17 CN disclosed
CN-117069942-A Polysiloxane compound, composition for forming film, laminate, touch panel, and method for forming cured film 阪田油墨株式会社 2023-11-17 CN disclosed
CN-114430767-B Composition for forming film, laminate coated with the composition, touch panel using the laminate, and method for forming cured film 阪田油墨株式会社 2023-04-28 CN disclosed
CN-109071693-B Resin composition for forming high refractive index cured film 日产化学株式会社 2021-05-11 CN disclosed
EP-3109914-B1 CHARGE-TRANSPORTING VARNISH NISSAN CHEMICAL CORP (JP) 2021-04-28 EP disclosed
WO-2021065211-A1 COATING FILM-FORMING COMPOSITION, LAMINATE OBTAINED BY COATING SAID COATING FILM-FORMING COMPOSITION, TOUCH PANEL OBTAINED BY USING SAID LAMINATE, AND METHOD FOR FORMING CURED COATING FILM サカタインクス株式会社 2021-04-08 WO disclosed
EP-3252840-B1 VARNISH FOR FORMATION OF CHARGE-TRANSPORTING THIN FILM NISSAN CHEMICAL CORP (JP) 2020-03-11 EP disclosed
WO-2008036274-A2 LOW VOC COATING COMPOSITIONS COMPRISING LOW MOLECULAR WEIGHT CELLULOSE MIXED ESTERS AND LOW MOLECULAR WEIGHT HYDROXYL-CONTAINING POLYMERS EASTMAN CHEMICAL COMPANY (US) 2008-03-27 WO disclosed
US-20080069963-A1 PROCESS FOR MAKING LOW VOC COATING COMPOSITIONS COMPRISING LOW MOLECULAR WEIGHT CELLULOSE MIXED ESTERS AND LOW MOLECULAR WEIGHT HYDROXY-CONTAINING POLYMERS EASTMAN CHEMICAL COMPANY (US) 2008-03-20 US disclosed
EP-1874826-A1 LOW MOLECULAR WEIGHT CELLULOSE MIXED ESTERS AND THEIR USE AS LOW VISCOSITY BINDERS AND MODIFIERS IN COATING COMPOSITIONS EASTMAN CHEMICAL COMPANY (US) 2008-01-09 EP disclosed
WO-2007145955-A2 METHODS FOR IMPROVING THE ANTI-SAG, LEVELING, AND GLOSS OF COATING COMPOSITIONS COMPRISING LOW MOLECULAR WEIGHT CELLULOSE MIXED ESTERS EASTMAN CHEMICAL COMPANY (US) 2007-12-21 WO disclosed
WO-2007145929-A2 COATING COMPOSITIONS COMPRISING LOW MOLECULAR WEIGHT CELLULOSE MIXED ESTERS AND THEIR USE TO IMPROVE ANTI-SAG, LEVELING, AND 20 DEGREE GLOSS EASTMAN CHEMICAL COMPANY (US) 2007-12-21 WO disclosed
US-20070282038-A1 Methods for improving the anti-sag, leveling, and gloss of coating compositions comprising low molecular weight cellulose mixed esters EASTMAN CHEMICAL COMPANY 2007-12-06 US disclosed
US-20070088105-A1 Low molecular weight cellulose mixed esters and their use as low viscosity binders and modifiers in coating compositions EASTMAN CHEMICAL COMPANY 2007-04-19 US disclosed
WO-2006116367-A1 LOW MOLECULAR WEIGHT CELLULOSE MIXED ESTERS AND THEIR USE AS LOW VISCOSITY BINDERS AND MODIFIERS IN COATING COMPOSITIONS EASTMAN CHEMICAL COMPANY (US) 2006-11-02 WO disclosed
US-20040181009-A1 Low molecular weight cellulose mixed esters and their use as low viscosity binders and modifiers in coating compositions EASTMAN CHEMICAL COMPANY 2004-09-16 US disclosed