Acetic Acid

Acetic Acid

SCHEMBL5083333

CC(=O)O.O=C(O)C=NCCO

nearest known ligand 0.33

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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 3)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33

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 SCHEMBL9223254 0.98 FFAR3 (0.32) FFAR3LCKFYN
SCHEMBL1601597 0.93
SCHEMBL1601599 0.93
Acetic Acid SCHEMBL783968 0.80 FFAR3 (0.37) FFAR3LCKFYN
SCHEMBL8651775 0.79 TSHR (0.33)
SCHEMBL8651771 0.79 TSHR (0.33)
Acetic Acid SCHEMBL6535003 0.77 AKR1B1 (0.34)
SCHEMBL3931614 0.76 TSHR (0.32)
Acetic Acid SCHEMBL9240467 0.75 FFAR3 (0.37) FFAR3LCKFYN
Acetic Acid SCHEMBL10922905 0.74 GPR84 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11939556-B2 Cleaning composition comprising an alkylamidoalkyl alkyldimonium alkylsulfate as an ionic liquid S. C. JOHNSON & SON, INC. (US) 2024-03-26 US claimed
EP-3532586-B1 DISINFECTANT CLEANING COMPOSITION WITH QUATERNARY AMMONIUM HYDROXYCARBOXYLATE SALT JOHNSON & SON INC S C (US) 2022-05-18 EP claimed
US-20210214653-A1 CLEANING COMPOSITION WITH IONIC LIQUID S.C. JOHNSON & SON, INC. (US) 2021-07-15 US claimed
US-10815453-B2 Disinfectant cleaning composition with quaternary ammonium hydroxycarboxylate salt and quaternary ammonium antimicrobial S. C. JOHNSON & SON, INC. (US) 2020-10-27 US claimed
US-10808204-B2 Aqueous cleaning composition with tertiary amine ionic liquid and quaternary ammonium antimicrobial surfactant S. C. JOHNSON & SON, INC. (US) 2020-10-20 US claimed
US-20200048585-A1 DISINFECTANT CLEANING COMPOSITION WITH QUATERNARY AMMONIUM HYDROXYCARBOXYLATE SALT S.C. JOHNSON & SON, INC. (US) 2020-02-13 US claimed
EP-3532585-A1 DISINFECTANT CLEANING COMPOSITION WITH QUATERNARY AMMONIUM HYDROXYCARBOXYLATE SALT S.C. Johnson & Son, Inc. (US) 2019-09-04 EP claimed
EP-3532586-A1 DISINFECTANT CLEANING COMPOSITION WITH QUATERNARY AMMONIUM HYDROXYCARBOXYLATE SALT S.C. Johnson & Son, Inc. (US) 2019-09-04 EP claimed
US-20190241839-A1 DISINFECTANT CLEANING COMPOSITION WITH QUATERNARY AMMONIUM HYDROXYCARBOXYLATE SALT S.C. JOHNSON & SON, INC. (US) 2019-08-08 US claimed
US-10179890-B2 Cleaning composition with di(fatty acyloxyalkyl)hydroxyalkyl alkylammonium quaternary salt or alkyl trimethyl ammonium fatty alkanoate ionic liquids S.C. JOHNSON & SON, INC. (US) 2019-01-15 US claimed
WO-2018080839-A1 DISINFECTANT CLEANING COMPOSITION WITH QUATERNARY AMMONIUM HYDROXYCARBOXYLATE SALT S. C. JOHNSON & SON, INC. (US) 2018-05-03 WO claimed
WO-2018080836-A1 DISINFECTANT CLEANING COMPOSITION WITH QUATERNARY AMMONIUM HYDROXYCARBOXYLATE SALT S. C. JOHNSON & SON, INC. (US) 2018-05-03 WO claimed
US-9920284-B2 Cleaning composition with a polypropdxylated 2-(trialkylammonio)ethanol ionic liquid S. C. JOHNSON & SON, INC. (US) 2018-03-20 US claimed
EP-3286293-A1 CLEANING COMPOSITION WITH IONIC LIQUID S.C. Johnson & Son, Inc. (US) 2018-02-28 EP claimed
WO-2016172024-A1 CLEANING COMPOSITION WITH IONIC LIQUID S.C. JOHNSON & SON, INC. (US) 2016-10-27 WO claimed
US-20160312155-A1 CLEANING COMPOSITION WITH IONIC LIQUID S.C. JOHNSON & SON, INC. (US) 2016-10-27 US claimed
EP-2862905-A1 Cationic water-dilutable binders ALLNEX AUSTRIA GmbH (AT) 2015-04-22 EP claimed
US-11939556-B2 Cleaning composition comprising an alkylamidoalkyl alkyldimonium alkylsulfate as an ionic liquid S. C. JOHNSON & SON, INC. (US) 2024-03-26 US disclosed
US-4049585-A BUILDERS, LOW SUDSING THE PROCTER & GAMBLE COMPANY (US) 1977-09-20 US disclosed
US-3864378-A Process for preparing 2-hydroxyethyliminodiacetonitrile BETHLEHEM STEEL CORP 1975-02-04 US disclosed