Acetic Acid

Acetic Acid

SCHEMBL926064

CC(=O)O.CNC(=N)N

nearest known ligand 0.00

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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Bicarbonate SCHEMBL11505805 0.90
Urea SCHEMBL28673164 0.87
Acetic Acid SCHEMBL27491964 0.84 FFAR3 (0.47)
SCHEMBL181641 0.83
Acetic Acid SCHEMBL19458352 0.81 FFAR3 (0.44)
Hydroxyguanidine SCHEMBL5282656 0.81
Pimagedine SCHEMBL1065359 0.81
Biguanide SCHEMBL27508171 0.81 FFAR3 (0.44)
Biguanide SCHEMBL28444535 0.81 FFAR3 (0.44)
Biguanide SCHEMBL28833765 0.81 FFAR3 (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102949802-B A kind of fire-extinguishing composite containing organic acid compound XI'AN JIAN RUI SAFETY EMERGENCY EQUIPMENT LIMITED LIABILITY COMPANY (CN) 2016-04-06 CN claimed
CN-102949802-A Organic acid compound-containing fire extinguishing composition SHAANXI J & R FIRE FIGHTING CO 2013-03-06 CN claimed
WO-2023205222-A1 MULTILAYER FORMULATION COMPRISING MODIFIED TAPIOCA STARCH FOR CONTROLLED-RELEASE OF ACTIVE AGENTS ACCESS BUSINESS GROUP INTERNATIONAL LLC (US) 2023-10-26 WO disclosed
US-20220369592-A1 Container for an Aqueous Composition SUSU PETS, LLC (US) 2022-11-24 US disclosed
CN-112135531-A Insulin control in overweight or obese adults during lifetime intervention N·V·努特里奇亚 2020-12-25 CN disclosed
US-20200396961-A1 CONTAINER FOR AN AQUEOUS COMPOSITION SUSU PETS LLC (US) 2020-12-24 US disclosed
WO-2020257438-A1 A CONTAINER FOR AN AQUEOUS COMPOSITION SUSU PETS, LLC (US) 2020-12-24 WO disclosed
US-20200121624-A1 MAGNESIUM COMPOSITIONS AND METHODS OF USE NEUROCENTRIA, INC. 2020-04-23 US disclosed
WO-2018200885-A1 MAGNESIUM COMPOSITIONS AND METHODS OF USE NEUROCENTRIA, INC. (US) 2018-11-01 WO disclosed
CN-102949802-B A kind of fire-extinguishing composite containing organic acid compound XI'AN JIAN RUI SAFETY EMERGENCY EQUIPMENT LIMITED LIABILITY COMPANY (CN) 2016-04-06 CN disclosed
US-20150064285-A1 SLOW RELEASE MAGNESIUM COMPOSITION AND USES THEREOF MAGCEUTICS, INC. (US) 2015-03-05 US disclosed
WO-2011003045-A1 SLOW RELEASE MAGNESIUM COMPOSITION AND USES THEREOF MAGCEUTICS, INC. (US) 2011-01-06 WO disclosed
CN-101292697-B Motion nutrition candy BEIJING COMPETITOR SPORTS TECHNOLOGY CO LTD 2010-12-29 CN disclosed
EP-1778205-B1 HYDRATING COMPOSITION UNIV GLASGOW (GB) 2009-02-25 EP disclosed
CN-101292697-A Motion nutrition candy BEIJING COMPETITOR SPORTS TECH (CN) 2008-10-29 CN disclosed
US-20070249559-A1 Hydrating Composition THE UNIVERSITY COURT OF THE UNIVERSITY OF GLASGOW (GB) 2007-10-25 US disclosed
EP-1778205-A1 HYDRATING COMPOSITION The University Court of the University of Glasgow (GB) 2007-05-02 EP disclosed
WO-2006008552-A1 HYDRATING COMPOSITION PITSILADIS YANNIS PAUL (GB) 2006-01-26 WO disclosed
EP-0300380-A1 Electrically conductive compositions Wacker Silicones Corporation (US) 1989-01-25 EP disclosed
EP-0183967-A1 Silicone elastomers having thermally conductive properties Wacker Silicones Corporation (US) 1986-06-11 EP disclosed