Acetic Acid

Acetic Acid

SCHEMBL4733805

CC(=O)O.CCCCOC(C)O

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Acetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
ATM Q13315 1/20 0.39
HCAR2 Q8TDS4 1/20 0.38
PLA2G4B P0C869 2/20 0.38
TSHR P16473 2/20 0.38
TP53 P04637 1/20 0.38
GPR84 Q9NQS5 3/20 0.38
FFAR1 O14842 1/20 0.38
CES2 O00748 1/20 0.36
HPGD P15428 1/20 0.36

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
Butanone SCHEMBL27467891 0.89 ALDH1A1 (0.45) ALDH1A1ATMTSHRCES2HPGD
SCHEMBL113503 0.89
SCHEMBL15510719 0.89
SCHEMBL8506709 0.86
Isopropyl Alcohol SCHEMBL1641692 0.86 TSHR (0.39) ALDH1A1ATMTSHR
Water SCHEMBL9170507 0.86
Methyl Alcohol SCHEMBL14895379 0.86 TSHR (0.39) ALDH1A1ATMTSHR
Adipic Acid SCHEMBL27174192 0.86 AKR1B1 (0.56) ALDH1A1TSHRGPR84FFAR1
Methyl Isobutyl Ketone SCHEMBL16531183 0.84 ALDH1A1 (0.52) ALDH1A1ATMPLA2G4BTSHRFFAR1
Alcohol SCHEMBL2853368 0.84 TSHR (0.42) ALDH1A1ATMTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3397402-B1 LOW BAKE AUTODEPOSITION COATINGS HENKEL AG & CO KGAA (DE) 2023-05-24 EP claimed
US-11426762-B2 Low bake autodeposition coatings HENKEL AG & CO. KGAA (DE) 2022-08-30 US claimed
EP-3397402-A1 LOW BAKE AUTODEPOSITION COATINGS Henkel AG & Co. KGaA (DE) 2018-11-07 EP claimed
US-20180304306-A1 LOW BAKE AUTODEPOSITION COATINGS HENKEL AG & CO. KGAA (DE) 2018-10-25 US claimed
WO-2017117169-A1 LOW BAKE AUTODEPOSITION COATINGS HENKEL AG & CO. KGAA (DE) 2017-07-06 WO claimed
EP-1411886-B1 NON-AEROSOL SHAVING GEL GILLETTE CO (US) 2005-02-23 EP claimed
US-20040251451-A1 Lacquer layer, which reflects infra-red radiation AIR PRODUCTS AND CHEMICALS, INC. 2004-12-16 US claimed
EP-1458823-A1 LACQUER LAYER REFLECTING INFRA-RED RADIATION Nanogate Technologies GmbH (DE) 2004-09-22 EP claimed
EP-1411886-A2 NON-AEROSOL SHAVING GEL THE GILLETTE COMPANY (US) 2004-04-28 EP claimed
US-6627185-B2 Mixture containing alkanolamine soap THE GILLETTE COMPANY 2003-09-30 US claimed
WO-2003050193-A1 LACQUER LAYER, WHICH REFLECTS INFRA-RED RADIATION NANOGATE TECHNOLOGIES GMBH (DE) 2003-06-19 WO claimed
WO-2003009823-A2 NON-AEROSOL SHAVING GEL THE GILLETTE COMPANY (US) 2003-02-06 WO claimed
US-20030021760-A1 None-aerosol Shaving gel THE GILLETTE COMPANY LLC 2003-01-30 US claimed
US-4386063-A WITH 2-PHENYL-3-CARBOETHOXYFURAN AND/OR BIS(CYCLOHEXYL)DISULFIDE; GRAPE INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-05-31 US claimed
US-4357316-A Use of 1-n-butoxy-1-ethanol acetate for augmenting or enhancing the taste of toothpaste INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-11-02 US claimed
US-4354953-A Process for augmenting or enhancing the aroma of detergents using 1-n-butoxy-1-ethanol acetate INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-10-19 US claimed
US-4333481-A 1-n-Butoxy-1-ethanol acetate and uses thereof for augmenting or enhancing the aroma or taste of consumable materials INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-06-08 US claimed
US-4331571-A 1-N-Butoxy-1-ethanol acetate useful for augmenting or enhancing the aroma of perfume materials INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-05-25 US claimed
US-4330417-A 1-N-Butoxy-1-ethanol acetate and uses thereof for augmenting or enhancing the aroma or taste of consumable materials INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1982-05-18 US claimed
US-4296138-A FOR FOOD, CHEWING GUM INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1981-10-20 US claimed