Acetic Acid

Acetic Acid

SCHEMBL4168552

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nearest known ligand 0.58

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 3/20 0.58
LCK P06239 1/20 0.58
FYN P06241 1/20 0.58
TSHR P16473 2/20 0.42
LMNA P02545 3/20 0.39
ALDH1A1 P00352 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
SLC15A2 Q16348 1/20 0.37
CAMK2A Q9UQM7 1/20 0.37
THPO P40225 1/20 0.36
TRPA1 O75762 1/20 0.35
CA1 P00915 2/20 0.33
OR51E2 Q9H255 1/20 0.33
GPR84 Q9NQS5 1/20 0.33
FFAR1 O14842 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
ALOX15 P16050 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
HDAC3 O15379 1/20 0.32

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 SCHEMBL29226934 1.00
Acetic Acid SCHEMBL1879030 0.96 FFAR3 (0.64) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL17909908 0.96 FFAR3 (0.64) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL36527 0.96
Acetic Acid SCHEMBL2516097 0.96 FFAR3 (0.64) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL7784606 0.96 FFAR3 (0.64) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL139024 0.96 FFAR3 (0.64) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL1578192 0.96 FFAR3 (0.64) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL8888237 0.96 FFAR3 (0.64) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL2959365 0.93 FFAR3 (0.50) FFAR3LCKFYNTSHRLMNA

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118330198-A Blood analysis and detection method and system 西安国联质量检测技术股份有限公司 2024-07-12 CN disclosed
CN-115836058-A Benzisoxazole derivatives 住友制药株式会社 2023-03-21 CN disclosed
WO-2021215423-A1 COSMETIC PREPARATION 株式会社 資生堂 (JP) 2021-10-28 WO disclosed
WO-2021215211-A1 COSMETIC 株式会社 資生堂 (JP) 2021-10-28 WO disclosed
CN-113396225-A Dynamic analysis method of intracellular compound 株式会社日立高新技术 2021-09-14 CN disclosed
CN-112689636-A Novel heteroatom aromatic amide derivative and drug containing the same 科研制药株式会社 2021-04-20 CN disclosed
EP-1880711-B1 Parakeratosis inhibitor, pore-shrinking agent and external composition for skin SHISEIDO CO LTD (JP) 2016-07-20 EP disclosed
US-9177691-B2 Polarizable nanoparticles and electrorheological fluid comprising same BAKER HUGHES INCORPORATED (US) 2015-11-03 US disclosed
US-8937090-B2 Parakeratosis inhibitor, pore-shrinking agent and external composition for skin SHISEIDO COMPANY, LTD. (JP) 2015-01-20 US disclosed
WO-2013043677-A1 POLARIZABLE NANOPARTICLES AND ELECTRORHEOLOGICAL FLUID COMPRISING SAME BAKER HUGHES INCORPORATED (US) 2013-03-28 WO disclosed
US-20130069022-A1 POLARIZABLE NANOPARTICLES AND ELECTRORHEOLOGICAL FLUID COMPRISING SAME BAKER HUGHES INCORPORATED (US) 2013-03-21 US disclosed
US-20120232111-A1 Parakeratosis inhibitor, pore -shrinking agent and external compositon for skin SHISEIDO COMPANY, LTD. (JP) 2012-09-13 US disclosed
US-20090215893-A1 Parakeratosis inhibitor, pore-shrinking agent,or rough skin preventing/ameliorating agent, and external composition for skin SHISEIDO COMPANY LTD (JP) 2009-08-27 US disclosed
EP-1884230-A1 PARAKERATOSIS INHIBITOR, PORE-SHRINKING AGENT OR AGENT FOR PREVENTING/AMELIORATING ROUGH SKIN AND EXTERNAL COMPOSITION FOR SKIN Shiseido Company, Limited (JP) 2008-02-06 EP disclosed
EP-1880711-A1 PARAKERATOSIS INHIBITOR, PORE-SHRINKING AGENT AND EXTERNAL COMPOSITION FOR SKIN Shiseido Company, Limited (JP) 2008-01-23 EP 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-20120232111-A1 Parakeratosis inhibitor, pore -shrinking agent and external compositon for skin CUTA, AAAS, NUP160 FFAR3 4404/4885LCK 3429/4885FYN 4232/4885
US-20090215893-A1 Parakeratosis inhibitor, pore-shrinking agent,or rough skin preventing/ameliorating agent, and external composition for skin CUTA, STOM, MTOR FFAR3 4555/4885LCK 1819/4885FYN 3790/4885

“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.