Acetic Acid

Acetic Acid

SCHEMBL1024317

CC(=O)O.CC(=O)OC(C)C

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
TSHR P16473 4/20 0.88
HCAR2 Q8TDS4 1/20 0.44
FFAR3 O14843 1/20 0.44
LCK P06239 1/20 0.44
FYN P06241 1/20 0.44
CHRM2 P08172 1/20 0.42
CHRM4 P08173 1/20 0.42
CHRM1 P11229 1/20 0.42
TBXA2R P21731 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
GALR3 O60755 1/20 0.41
MAPT P10636 1/20 0.41
BLM P54132 1/20 0.41
ALOX15 P16050 1/20 0.38
ALDH1A1 P00352 2/20 0.37
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
CA12 O43570 2/20 0.35

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 SCHEMBL28586247 1.00 TSHR (0.88) TSHRHCAR2FFAR3LCKFYN
Acetic Acid SCHEMBL28160735 0.94 TSHR (0.78) TSHRHCAR2FFAR3LCKFYN
Bicarbonate SCHEMBL11023772 0.94 TSHR (0.88) TSHRHCAR2FFAR3LCKFYN
SCHEMBL19193 0.94
SCHEMBL21064874 0.94 TSHR (1.00) TSHRHCAR2CHRM2CHRM4CHRM1
Benzene SCHEMBL8104016 0.91 TSHR (0.82) TSHRHCAR2CHRM2CHRM4CHRM1
Methyl Alcohol SCHEMBL584909 0.90
SCHEMBL3495565 0.90
Ammonia Solution, Strong SCHEMBL5086843 0.90
Hydrochloric Acid SCHEMBL2107550 0.90

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115109109-B Synthesis process and application of acetaminophen 天津大学 2023-09-05 CN claimed
CN-115109109-A Synthesis process and application of acetamido abamectin 天津大学 2022-09-27 CN claimed
CN-114886853-A Solid dispersions of ErbB2(HER2) inhibitors 阵列生物制药公司 2022-08-12 CN claimed
EP-4337470-A1 INKJET INK COMPOSITIONS Videojet Technologies, Inc. (US) 2024-03-20 EP disclosed
US-20240076511-A1 INKJET INK COMPOSITIONS VIDEOJET TECHNOLOGIES INC (US) 2024-03-07 US disclosed
CN-117642294-A Inkjet ink composition 录象射流技术公司 2024-03-01 CN disclosed
EP-4252855-A2 COMPOUNDS FOR USE IN THE TREATMENT OF BRAIN METASTASES IN A PATIENT WITH ERBB2+ BREAST CANCER Array Biopharma, Inc. (US) 2023-10-04 EP disclosed
CN-115109109-B Synthesis process and application of acetaminophen 天津大学 2023-09-05 CN disclosed
CN-115109109-B Synthesis process and application of acetaminophen 天津大学 2023-09-05 CN disclosed
US-20230271947-A1 SALT AND CRYSTAL FORM OF KETOHEXOKINASE INHIBITOR AND USE THEREOF Xuanzhu Biopharmaceutical Co., Ltd. (CN) 2023-08-31 US disclosed
US-20230241066-A1 POLYMORPHS OF ARRY-380, A SELECTIVE HER2 INHIBITOR AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ARRAY BIOPHARMA INC. (US) 2023-08-03 US disclosed
EP-0944572-A1 PRODUCTION OF ORGANIC CARBOXYLIC ACID ESTERS Sasol Technology (Proprietary) Limited (ZA) 1999-09-29 EP disclosed
WO-1998025876-A1 PRODUCTION OF ORGANIC CARBOXYLIC ACID ESTERS SASOL TECHNOLOGY (PROPRIETARY) LIMITED (ZA) 1998-06-18 WO disclosed
US-4611028-A ACRYLIC COPOLYMERS FORD MOTOR COMPANY (US) 1986-09-09 US disclosed
EP-0051400-B1 POLYMERIC STABILIZER, STABLE DISPERSIONS PREPARED THEREFROM AND PAINT COMPOSITIONS COMPRISING SUCH DISPERSIONS FORD MOTOR COMPANY LIMITED (GB) 1986-03-12 EP disclosed
US-4504415-A Synthesis of thymosin α1 and desacetyl thymosin α1 HOFFMAN-LA ROCHE INC. (US) 1985-03-12 US disclosed
US-4425450-A LOW SOLVENT CONTENT FORD MOTOR COMPANY (US) 1984-01-10 US disclosed
US-4415681-A ACRYLIC RESINS AND BUTYLATED MELAMINE-FORMALDEHYDE RESIN STABILIZER; AUTOMOBILE PAINTS FORD MOTOR COMPANY (US) 1983-11-15 US disclosed
US-4415697-A ACRYLIC THERMOSETTING RESINS; AUTOMOBILES; VARNISHES; METALLIZED COATINGS; LACQUERS FORD MOTOR COMPANY (US) 1983-11-15 US disclosed
EP-0051400-A2 Polymeric stabilizer, stable dispersions prepared therefrom and paint compositions comprising such dispersions FORD MOTOR COMPANY LIMITED (GB) 1982-05-12 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-20230271947-A1 SALT AND CRYSTAL FORM OF KETOHEXOKINASE INHIBITOR AND USE THEREOF KHK, HK1, HKDC1 TSHR 3782/4885HCAR2 1187/4885FFAR3 978/4885
US-20230241066-A1 POLYMORPHS OF ARRY-380, A SELECTIVE HER2 INHIBITOR AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ERBB2, ERBB3, ERBB4 TSHR 875/4885HCAR2 3239/4885FFAR3 1514/4885

“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.