Acetic Acid

Acetic Acid

SCHEMBL690750

CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CCCCCCC(CCCCCC)C(=O)OCC

nearest known ligand 0.53

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 16)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 2/20 0.53
CA2 P00918 3/20 0.48
GRIK1 P39086 2/20 0.47
GRIK2 Q13002 2/20 0.47
GPR84 Q9NQS5 7/20 0.47
FFAR1 O14842 1/20 0.47
ZDHHC7 Q9NXF8 1/20 0.46
MAPT P10636 1/20 0.46
LCK P06239 1/20 0.46
PPARD Q03181 1/20 0.46
ZDHHC20 Q5W0Z9 1/20 0.46
ZDHHC2 Q9UIJ5 1/20 0.46
SLC1A2 P43004 1/20 0.44
SLC1A1 P43005 1/20 0.44
CA1 P00915 1/20 0.44
MAPK1 P28482 1/20 0.44

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 SCHEMBL1767861 1.00 CPB2 (0.53) CPB2CA2GRIK1GRIK2GPR84
Acetic Acid SCHEMBL8675920 1.00 CPB2 (0.53) CPB2CA2GRIK1GRIK2GPR84
Acetic Acid SCHEMBL324428 1.00 CPB2 (0.53) CPB2CA2GRIK1GRIK2GPR84
Acetic Acid SCHEMBL615639 1.00 CPB2 (0.53) CPB2CA2GRIK1GRIK2GPR84
Acetic Acid SCHEMBL4741906 1.00 CPB2 (0.53) CPB2CA2GRIK1GRIK2GPR84
Acetic Acid SCHEMBL1929473 1.00 CPB2 (0.53) CPB2CA2GRIK1GRIK2GPR84
Acetic Acid SCHEMBL3260062 1.00 CPB2 (0.53) CPB2CA2GRIK1GRIK2GPR84
SCHEMBL25341592 0.94 CPB2 (0.58) CPB2CA2GRIK1GRIK2GPR84
SCHEMBL571313 0.94 CPB2 (0.58) CPB2CA2GRIK1GRIK2GPR84
SCHEMBL19148651 0.94 CPB2 (0.58) CPB2CA2GRIK1GRIK2GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11647749-B2 Fungicidal compositions SYNGENTA PARTICIPATIONS AG (CH) 2023-05-16 US disclosed
US-20230113346-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION LLC (US) 2023-04-13 US disclosed
US-20200163337-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION, LLC (US) 2020-05-28 US disclosed
US-10575523-B2 Fungicidal compositions SYNGENTA CROP PROTECTION LLC (US) 2020-03-03 US disclosed
US-20190053491-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION, LLC (US) 2019-02-21 US disclosed
US-10143201-B2 Fungicidal compositions SYNGENTA CROP PROTECTION, LLC (US) 2018-12-04 US disclosed
US-20170202220-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION, LLC (US) 2017-07-20 US disclosed
US-9642365-B2 Fungicidal compositions SYNGENTA CROP PROTECTION, LLC (US) 2017-05-09 US disclosed
US-20160192655-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION, LLC (US) 2016-07-07 US disclosed
US-9314022-B2 Fungicidal compositions SYNGENTA CROP PROTECTION, LLC (US) 2016-04-19 US disclosed
EP-2193714-A1 Fungicidal Compositions Sygenta Participations AG. (CH) 2010-06-09 EP disclosed
EP-2193715-A1 Fungicidal Compositions Sygenta Participations AG. (CH) 2010-06-09 EP disclosed
EP-2193716-A1 Fungicidal Compositions Syngenta Participations AG (CH) 2010-06-09 EP disclosed
EP-2193717-A1 Fungicidal Compositions Sygenta Participations AG. (CH) 2010-06-09 EP disclosed
US-7732469-B2 for controlling or preventing infestation of plants by phytopathogenic microorganisms, preferably fungi SYNGENTA CROP PROTECTION, INC. (US) 2010-06-08 US disclosed
EP-2150113-A1 FUNGICIDAL COMPOSITIONS Syngeta Participations AG (CH) 2010-02-10 EP disclosed
WO-2008131901-A1 FUNGICIDAL COMPOSITIONS SYNGENTA PARTICIPATIONS AG (CH) 2008-11-06 WO disclosed
US-20080227835-A1 Heterocyclic Amide Derivatives Useful as Microbiocides SYNGENTA CROP PROTECTION, INC. (US) 2008-09-18 US disclosed
EP-1940813-A1 HETEROCYCLIC AMIDE DERIVATIVES USEFUL AS MICROBIOCIDES Syngeta Participations AG (CH) 2008-07-09 EP disclosed
WO-2007048556-A1 HETEROCYCLIC AMIDE DERIVATIVES USEFUL AS MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2007-05-03 WO 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 (9 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-11647749-B2 Fungicidal compositions BROX, RER1, BLVRB CPB2 3284/4885CA2 3451/4885GRIK1 1677/4885
US-20190053491-A1 FUNGICIDAL COMPOSITIONS BROX, RER1, BLVRB CPB2 3284/4885CA2 3451/4885GRIK1 1677/4885
US-20160192655-A1 FUNGICIDAL COMPOSITIONS BROX, RER1, BLVRB CPB2 3284/4885CA2 3451/4885GRIK1 1677/4885
US-10143201-B2 Fungicidal compositions BROX, RER1, BLVRB CPB2 3284/4885CA2 3451/4885GRIK1 1677/4885
US-20170202220-A1 FUNGICIDAL COMPOSITIONS BROX, RER1, BLVRB CPB2 3284/4885CA2 3451/4885GRIK1 1677/4885
US-10575523-B2 Fungicidal compositions BROX, RER1, BLVRB CPB2 3284/4885CA2 3451/4885GRIK1 1677/4885
US-20230113346-A1 FUNGICIDAL COMPOSITIONS BROX, RER1, BLVRB CPB2 3284/4885CA2 3451/4885GRIK1 1677/4885
US-20200163337-A1 FUNGICIDAL COMPOSITIONS BROX, RER1, BLVRB CPB2 3284/4885CA2 3451/4885GRIK1 1677/4885
US-20080227835-A1 Heterocyclic Amide Derivatives Useful as Microbiocides CBR3, CBR1, CYP8B1 CPB2 3063/4885CA2 1228/4885GRIK1 3031/4885

“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.