Acetic Acid

Acetic Acid

SCHEMBL3012541

CC(=O)O.CC(=O)O.CC(=O)O.F.F.F

nearest known ligand 0.88

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 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 2/20 0.88
LCK P06239 1/20 0.88
FYN P06241 1/20 0.88
LMNA P02545 3/20 0.56
TSHR P16473 2/20 0.50
THPO P40225 1/20 0.50
CA1 P00915 3/20 0.46
ALOX15 P16050 1/20 0.46
BLM P54132 1/20 0.46
PMP22 Q01453 1/20 0.46
CA2 P00918 2/20 0.44
CA9 Q16790 1/20 0.44
ALDH1A1 P00352 5/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 1/20 0.39
PTGS1 P23219 1/20 0.39
MMP12 P39900 1/20 0.39
CA4 P22748 1/20 0.39
SLC15A2 Q16348 1/20 0.38
ACHE P22303 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
Acetic Acid SCHEMBL27145924 1.00
Acetic Acid SCHEMBL28097741 1.00
Acetic Acid SCHEMBL4823161 1.00
Acetic Acid SCHEMBL3012542 1.00
Acetic Acid SCHEMBL2224826 1.00
Acetic Acid SCHEMBL10520351 0.94
Acetic Acid SCHEMBL6048835 0.94
Acetic Acid SCHEMBL6291257 0.94
Acetic Acid SCHEMBL3873115 0.94
Acetic Acid SCHEMBL912396 0.94

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4952661-A AND DICARBOXYLIC AROMATIC ACID, AND OPTIONALLY A HYDROQUINONE; ANISOTROPIC MONTEDISON S.P.A. (IT) 1990-08-28 US claimed
EP-0300752-A2 Thermotropic liquid crystalline polyesters Montedison S.p.A. (IT) 1989-01-25 EP claimed
JP-5155847-A None JP disclosed
WO-2024017294-A1 PREPARATION AND USE OF QUINAZOLINONE DERIVATIVE AS KINASE INHIBITOR 西藏海思科制药有限公司 2024-01-25 WO disclosed
WO-2023051303-A1 METAL OXIDE MATERIAL AND PREPARATION METHOD THEREFOR, AND OPTOELECTRONIC DEVICE TCL科技集团股份有限公司 2023-04-06 WO disclosed
EP-3853228-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV Healthcare UK (No.5) Limited (GB) 2021-07-28 EP disclosed
WO-2020058844-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV Healthcare UK (No.5) Limited (GB) 2020-03-26 WO disclosed
CN-105481915-A Preparation method of SGLT-2 inhibitor compound BEIJING WINSUNNY PHARMACEUTICAL CO LTD 2016-04-13 CN disclosed
US-8501985-B2 Use of phosphonium salts in coupling reactions and process for their manufacture DYNAMIT NOBEL GMBH EXPLOSIVSTOFF-UND SYSTEMTECHNIK (DE) 2013-08-06 US disclosed
US-20100197969-A1 USE OF PHOSPHONIUM SALTS IN COUPLING REACTIONS AND PROCESS FOR THEIR MANUFACTURE DYNAMIT NOBEL GMBH EXPLOSIVSTOFF-UND SYSTEMTECHNIK (DE) 2010-08-05 US disclosed
EP-1856083-A4 CHROMEN-4-ONE INHIBITORS OF ANTI-APOPTOTIC BCL-2 FAMILY MEMBERS AND THE USES THEREOF UNIV MICHIGAN (US) 2009-05-27 EP disclosed
EP-2019107-A1 Use of phosphonium salts in coupling reactions and process for their manufacture Dynamit Nobel GmbH Explosivstoff- und Systemtechnik (DE) 2009-01-28 EP disclosed
EP-1856083-A2 CHROMEN-4-ONE INHIBITORS OF ANTI-APOPTOTIC BCL-2 FAMILY MEMBERS AND THE USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2007-11-21 EP disclosed
US-20060247305-A1 Chromen-4-one inhibitors of anti-apoptotic Bcl-2 family members and the uses thereof REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2006-11-02 US disclosed
WO-2006099193-A2 CHROMEN-4-ONE INHIBITORS OF ANTI-APOPTOTIC BCL-2 FAMILY MEMBERS AND THE USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2006-09-21 WO disclosed
WO-2003087047-A1 METAL CHELATE COMPOSITION, MACROMOLECULE COMPLEX THEREOF, PREPARING METHOD THEREOF AND USE PEPTRON CO., LTD. (KR) 2003-10-23 WO disclosed
JP-2000212742-A METHOD FOR REPRODUCING METALLIC CVD PRECURSOR AIR PROD AND CHEM INC 2000-08-02 JP disclosed
CN-1034416-Y With comfortable kinin antagonists for the preparation method of peptide He toru spa 1997-04-02 CN disclosed
US-4360527-A 9-(Hydroxy, lower alkoxy or lower alkanoyloxy)-2-(1H-tetrazol-5-yl)naphtho-(2,1-b)-pyran-1-ones and anti-allergic use thereof WARNER-LAMBERT COMPANY (US) 1982-11-23 US disclosed
US-4225722-A Process for the production of 2-(1H-tetrazol-5-yl)-9-hydroxy-1-oxo-1H-naphtho-(2,1-b) pyran and intermediates therefor WARNER-LAMBERT COMPANY (US) 1980-09-30 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 (2 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-20060247305-A1 Chromen-4-one inhibitors of anti-apoptotic Bcl-2 family members and the uses thereof BCL2, BAD, BAX FFAR3 3766/4885LCK 1089/4885FYN 2226/4885
US-20100197969-A1 USE OF PHOSPHONIUM SALTS IN COUPLING REACTIONS AND PROCESS FOR THEIR MANUFACTURE PPIP5K2, PHOSPHO1, PNKP FFAR3 4551/4885LCK 159/4885FYN 45/4885

“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.