Acetic Acid

Acetic Acid

SCHEMBL1056731

C=CC[N+](C)(C)CC=C.CC(=O)[O-]

nearest known ligand 0.59

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 12)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 4/20 0.59
CA1 P00915 2/20 0.40
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
ALDH1A1 P00352 2/20 0.35
ACHE P22303 5/20 0.34
BCHE P06276 2/20 0.34
TSHR P16473 1/20 0.32
BLM P54132 1/20 0.31
CA4 P22748 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRNA7 P36544 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
Bicarbonate SCHEMBL2512299 0.92 BBOX1 (0.61) BBOX1KMT2AATMALDH1A1ACHE
Bicarbonate SCHEMBL2704202 0.90 BBOX1 (0.59) BBOX1KMT2AATMALDH1A1ACHE
Methacrylic Acid SCHEMBL30149857 0.89 BBOX1 (0.53) BBOX1KMT2AATMALDH1A1ACHE
Bicarbonate SCHEMBL2836768 0.88 BBOX1 (0.57) BBOX1KMT2AATMALDH1A1ACHE
Bicarbonate SCHEMBL5911592 0.88 BBOX1 (0.57) BBOX1KMT2AATMALDH1A1ACHE
Acrylic Acid SCHEMBL2526435 0.88 BBOX1 (0.57) BBOX1KMT2AATMALDH1A1ACHE
Methacrylic Acid SCHEMBL27590683 0.87 BBOX1 (0.52) BBOX1KMT2AATMALDH1A1ACHE
Acrylic Acid SCHEMBL11323113 0.86 BBOX1 (0.55) BBOX1KMT2AATMALDH1A1ACHE
Succinic Acid SCHEMBL28710003 0.86 BBOX1 (0.71) BBOX1KMT2AATMACHEBCHE
Bicarbonate SCHEMBL28034606 0.86 BBOX1 (0.55) BBOX1KMT2AATMALDH1A1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2643364-B1 METHODS OF PREPARING NOVEL HALIDE ANION FREE QUATERNARY AMMONIUM SALT MONOMERS, POLYMERIZATION METHODS THEREFOR, AND METHODS OF USE OF THE RESULTING POLYMERS GEN ELECTRIC (US) 2016-02-10 EP claimed
US-8858803-B2 Methods of preparing novel halide anion free quaternary ammonium salt monomers, polymerization methods therefor, and methods of use of the resulting polymers GENERAL ELECTRIC COMPANY (US) 2014-10-14 US claimed
EP-2643364-A1 METHODS OF PREPARING NOVEL HALIDE ANION FREE QUATERNARY AMMONIUM SALT MONOMERS, POLYMERIZATION METHODS THEREFOR, AND METHODS OF USE OF THE RESULTING POLYMERS General Electric Company (US) 2013-10-02 EP claimed
WO-2012071223-A1 METHODS OF PREPARING NOVEL HALIDE ANION FREE QUATERNARY AMMONIUM SALT MONOMERS, POLYMERIZATION METHODS THEREFOR, AND METHODS OF USE OF THE RESULTING POLYMERS GENERAL ELECTRIC COMPANY (US) 2012-05-31 WO claimed
US-20120125863-A1 METHODS OF PREPARING NOVEL HALIDE ANION FREE QUATERNARY AMMONIUM SALT MONOMERS, POLYMERIZATION METHODS THEREFOR, AND METHODS OF USE OF THE RESULTING POLYMERS GENERAL ELECTRIC COMPANY (US) 2012-05-24 US claimed
US-20040142123-A1 Ink-jet recording material AGFA-GEVAERT (BE) 2004-07-22 US claimed
EP-1437230-A1 Ink-jet recording material Agfa-Gevaert (BE) 2004-07-14 EP claimed
EP-0617996-A1 Polyelectrolyte membranes for the separation of acid gases AIR PRODUCTS AND CHEMICALS, INC. (US) 1994-10-05 EP claimed
US-5336298-A Contacting gas stream with polyelectrolyte polymer containing cationic groups AIR PRODUCTS AND CHEMICALS, INC. (US) 1994-08-09 US claimed
US-12515178-B1 Grafted polyamide membrane for nanofiltration applications KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2026-01-06 US disclosed
EP-3497435-B1 INORGANIC ION DETECTION SYSTEM AND METHODS UNIV TASMANIA (AU) 2023-07-12 EP disclosed
CN-109716122-B Inorganic ion detection system and method 塔斯马尼亚大学 2022-06-24 CN disclosed
US-20190353614-A1 INORGANIC ION DETECTION SYSTEM AND METHODS UNIVERSITY OF TASMANIA (AU) 2019-11-21 US disclosed
EP-3497435-A1 INORGANIC ION DETECTION SYSTEM AND METHODS University Of Tasmania (AU) 2019-06-19 EP disclosed
EP-0830952-A2 Ink jet recording sheet KONICA CORPORATION (JP) 1998-03-25 EP disclosed
EP-0627324-B1 Ink jet recording medium MITSUBISHI PAPER MILLS LTD (JP) 1997-01-02 EP disclosed
US-5439739-A Support having ink receiving layer containing crosslinked water soluble polymer with repeating units derived from quaternary ammonium salts, amines, acids and amides; water resistance MITSUBISHI PAPER MILLS LIMITED (JP) 1995-08-08 US disclosed
EP-0627324-A1 Ink jet recording medium MITSUBISHI PAPER MILLS, LTD. (JP) 1994-12-07 EP disclosed
EP-0617996-A1 Polyelectrolyte membranes for the separation of acid gases AIR PRODUCTS AND CHEMICALS, INC. (US) 1994-10-05 EP disclosed
US-5336298-A Contacting gas stream with polyelectrolyte polymer containing cationic groups AIR PRODUCTS AND CHEMICALS, INC. (US) 1994-08-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120125863-A1 METHODS OF PREPARING NOVEL HALIDE ANION FREE QUATERNARY AMMONIUM SALT MONOMERS, POLYMERIZATION METHODS THEREFOR, AND METHODS OF USE OF THE RESULTING POLYMERS SLC6A11, FAR1, HASPIN BBOX1 1723/4885CA1 2335/4885KMT2A 2380/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.