Acetic Acid Butyl Ester

Acetic Acid Butyl Ester

SCHEMBL534058

CCCCOC(C)=O.COCC(C)OC(C)=O

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.62
ATM Q13315 1/20 0.40
TSHR P16473 5/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM1 P11229 1/20 0.39
TBXA2R P21731 1/20 0.39
PRKCA P17252 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 1/20 0.38
GALR3 O60755 1/20 0.38
MAPT P10636 1/20 0.38
BLM P54132 1/20 0.38
FAAH O00519 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
HCAR2 Q8TDS4 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL29283673 0.91 ALDH1A1 (0.50) ALDH1A1TSHRCHRM2CHRM4CHRM1
SCHEMBL27200580 0.91 ALDH1A1 (0.50) ALDH1A1TSHRCHRM2CHRM4CHRM1
Hexane SCHEMBL28211851 0.89 TSHR (0.44) ALDH1A1TSHRCHRM2CHRM4CHRM1
SCHEMBL28120656 0.88 ALDH1A1 (0.44) ALDH1A1TSHRCHRM2CHRM4CHRM1
Acetic Acid Butyl Ester SCHEMBL11469747 0.86 ALDH1A1 (0.67) ALDH1A1ATMTSHRCHRM2CHRM4
Propylene Glycol Diacetate SCHEMBL16007982 0.85 ALDH1A1 (0.49) ALDH1A1ATMTSHRCHRM2CHRM4
Butyl Alcohol SCHEMBL27797394 0.84 TSHR (0.40) ALDH1A1TSHRCHRM2CHRM4CHRM1
Acetic Acid Butyl Ester SCHEMBL28080124 0.84 ALDH1A1 (0.64) ALDH1A1ATMTSHRCHRM2CHRM4
Acetic Acid Butyl Ester SCHEMBL28080215 0.84 ALDH1A1 (0.64) ALDH1A1ATMTSHRCHRM2CHRM4
Ethyl Acetate SCHEMBL5905815 0.84 ALDH1A1 (0.54) ALDH1A1TSHRCHRM2CHRM4CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109722141-A A kind of elasticity grains of sand paint and preparation method thereof 东来涂料技术(上海)股份有限公司 2019-05-07 CN disclosed
US-8771717-B2 Interference pigments on the basis of perlite flakes BASF SE (DE) 2014-07-08 US disclosed
EP-2376581-B1 INTERFERENCE PIGMENTS ON THE BASIS OF PERLITE FLAKES BASF SE (DE) 2013-07-03 EP disclosed
EP-1487920-B1 ANTHRAQUINONE DYES HUNTSMAN ADV MAT SWITZERLAND (CH) 2012-02-15 EP disclosed
EP-1487922-B1 AZO DYES HUNTSMAN ADV MAT SWITZERLAND (CH) 2012-02-08 EP disclosed
US-20110269845-A1 INTERFERENCE PIGMENTS ON THE BASIS OF PERLITE FLAKES BASF SE (DE) 2011-11-03 US disclosed
EP-1328587-B1 MONOAZOQUINOLONE PIGMENTS, PROCESS FOR THEIR PREPARATION AND THEIR USE BASF SE (DE) 2011-04-20 EP disclosed
US-7892606-B2 Method of preparing nano-structured surface coatings and coated articles DSM IP ASSETS B.V. (NL) 2011-02-22 US disclosed
US-7704608-B2 Method of preparing nano-structured surface coatings and coated articles DSM IP ASSETS B.V. (NL) 2010-04-27 US disclosed
US-7456316-B2 Anthraquinone dyes HUNTSMAN INTERNATIONAL LLC (US) 2008-11-25 US disclosed
WO-2003042989-A1 COMPOSITIONS COMPRISING AT LEAST ONE OXONOL DYE AND AT LEAST ONE METAL COMPLEX CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-05-22 WO disclosed
US-6544325-B2 Used ot prepare color filters for liquid- crystal displays (LCDs) CIBA SPECIALTY CHEMICALS CORPORATION 2003-04-08 US disclosed
WO-2002034839-A1 MONOAZOQUINOLONE PIGMENTS, PROCESS FOR THEIR PREPARATION AND THEIR USE CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2002-05-02 WO disclosed
US-20020014183-A1 Pigmentary copper phthalocyanine solid solution and transparent dispersion comprising it CIBA SPECIALTY CHEMICALS CORP. 2002-02-07 US disclosed
EP-0996657-A1 HYDROXY-FUNCTIONAL OLIGOMERS FOR HIGH SOLIDS COATINGS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2000-05-03 EP disclosed
WO-1999003908-A1 HYDROXY-FUNCTIONAL OLIGOMERS FOR HIGH SOLIDS COATINGS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-01-28 WO disclosed
EP-0699123-A1 LIQUID MOLDING COMPOUND AND METHOD AND APPARTUS FOR FORMING ARTICLES THEREFROM AEROQUIP CORPORATION (US) 1996-03-06 EP disclosed
EP-0699123-A4 LIQUID MOLDING COMPOUND AND METHOD AND APPARTUS FOR FORMING ARTICLES THEREFROM AEROQUIP CORP (US) 1996-01-10 EP disclosed
US-5424017-A Injecting into mold; compression molding AEROQUIP CORPORATION 1995-06-13 US disclosed
WO-1994023924-A1 LIQUID MOLDING COMPOUND AND METHOD AND APPARTUS FOR FORMING ARTICLES THEREFROM AEROQUIP CORPORATION (US) 1994-10-27 WO disclosed