Acetic Acid

Acetic Acid

SCHEMBL168535

CC(=O)O.CC(=O)O.CC(=O)O.CCC(N)(O)CN

nearest known ligand 0.38

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 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
CYP1A2 P05177 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 2/20 0.35
THRB P10828 1/20 0.35
FFAR3 O14843 2/20 0.35
LCK P06239 1/20 0.35
FYN P06241 1/20 0.35
KDM4E B2RXH2 1/20 0.34
GRM2 Q14416 1/20 0.31
GRM3 Q14832 1/20 0.31
GGT1 P19440 1/20 0.31
ARG1 P05089 1/20 0.31
ARG2 P78540 1/20 0.31
GLRA1 P23415 1/20 0.30
SLC6A9 P48067 1/20 0.30
OR51E2 Q9H255 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
FDPS P14324 1/20 0.30

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 SCHEMBL5446128 1.00 MEN1 (0.35) MEN1CYP1A2KMT2AALDH1A1THRB
Acetic Acid SCHEMBL1970151 0.98 MEN1 (0.34) MEN1CYP1A2KMT2AALDH1A1THRB
Carbamic Acid SCHEMBL19211626 0.90 MEN1 (0.35) MEN1CYP1A2KMT2AALDH1A1THRB
SCHEMBL321976 0.87
Acetic Acid SCHEMBL1970150 0.86 CA1 (0.41) FFAR3
Acetic Acid SCHEMBL5083116 0.86 CA1 (0.36)
Acetic Acid SCHEMBL5082566 0.86 CA1 (0.36)
SCHEMBL20678765 0.84
Trimethylammonium SCHEMBL27297434 0.79
Methyl Isobutyl Ketone SCHEMBL28129670 0.79 ALDH1A1 (0.54) ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4504163-A1 NOVEL ORAL CARE FORMULATIONS FOR TREATMENT OF XEROSTOMIA Livionex, Inc. (US) 2025-02-12 EP claimed
WO-2023196667-A1 NOVEL ORAL CARE FORMULATIONS FOR TREATMENT OF XEROSTOMIA LIVIONEX, Inc. (US) 2023-10-12 WO claimed
WO-2023147169-A2 NOVEL LIQUID FORMULATIONS FOR IRON CHELATION LIVIONEX, Inc. (US) 2023-08-03 WO claimed
WO-2023126846-A2 CATALYST FOR CUMENE HYDROPEROXIDE DECOMPOSITION AND PROCESS FOR PREPARATION THEREOF PTT GLOBAL CHEMICAL PUBLIC COMPANY LIMITED (TH) 2023-07-06 WO claimed
CN-111335864-B High-permeability heterogeneous sandstone reservoir steering acidification method 西南石油大学 2022-07-29 CN claimed
WO-2019228669-A1 COSMETIC PRESERVATIVE SYSTEM THE BOOTS COMPANY PLC (GB) 2019-12-05 WO claimed
US-10414666-B2 Surface-modified cyanide-based transition metal compounds NATRON ENERGY, INC. (US) 2019-09-17 US claimed
EP-3478250-A1 HAIR CARE COMPOSITIONS FOR CALCIUM CHELATION The Procter and Gamble Company (US) 2019-05-08 EP claimed
US-20180105432-A1 SURFACE-MODIFIED CYANIDE-BASED TRANSITION METAL COMPOUNDS NATRON ENERGY, INC. (US) 2018-04-19 US claimed
WO-2018005262-A1 HAIR CARE COMPOSITIONS FOR CALCIUM CHELATION THE PROCTER & GAMBLE COMPANY (US) 2018-01-04 WO claimed
US-20160293932-A1 SYNTHETIC METHODS FOR TRANSITION METAL COORDINATION COMPOUNDS Alveo Energy, Inc. (US) 2016-10-06 US claimed
US-9359219-B1 Surface-modified cyanide-based transition metal compounds Alveo Energy, Inc. (US) 2016-06-07 US claimed
EP-3022280-A1 MILD ALKALINE SOLID INSTRUMENT CLEANER Ecolab USA Inc. (US) 2016-05-25 EP claimed
US-9299981-B1 Surface-modified cyanide-based transition metal compounds Alveo Energy, Inc. (US) 2016-03-29 US claimed
WO-2015158385-A1 COMPOSITIONS AND METHODS USEFUL FOR REMOVING TABLET COATINGS ECOLAB INC. (US) 2015-10-22 WO claimed
WO-2015055234-A1 USE OF AN ACTIVE SOLID FOR CLEANING AND INACTIVATING UNCONVENTIONAL INFECTIOUS AGENTS ON SURFACES ECOLAB INC. (US) 2015-04-23 WO claimed
WO-2015007347-A1 MILD ALKALINE SOLID INSTRUMENT CLEANER ECOLAB INC. (US) 2015-01-22 WO claimed
US-20090107851-A1 Electrolytic polishing method of substrate EBARA CORPORATION (JP) 2009-04-30 US claimed
US-20050087718-A1 Comprises aqueous solution containing calcium or calcium hydroxidet; prevents hair and animal fiber damage associated with permanent wave treatments, bleaching treatments YUGEN KAISHA H&K ASSOCIATE (JP) 2005-04-28 US claimed
WO-1998053893-A1 EXTRACTION AGENTS AND METHOD FOR USE THEREOF HAMPSHIRE CHEMICAL AB (SE) 1998-12-03 WO claimed