Acetic Acid

Acetic Acid

SCHEMBL3462809

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nearest known ligand 0.56

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
GAA P10253 2/20 0.56
MGAM O43451 1/20 0.56
SI P14410 1/20 0.56
MGAM2 Q2M2H8 1/20 0.56
CYP4F2 P78329 3/20 0.50
CYP4A11 Q02928 3/20 0.50
CYP1A2 P05177 1/20 0.50
ALDH1A1 P00352 4/20 0.46
TRPA1 O75762 1/20 0.46
LMNA P02545 2/20 0.46
HSD17B10 Q99714 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.41
NR1I2 O75469 1/20 0.40
PGR P06401 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
PTGS2 P35354 1/20 0.40
PDE4D Q08499 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 2/20 0.39
TSHR P16473 1/20 0.39

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 SCHEMBL6720383 1.00 GAA (0.56) GAAMGAMSIMGAM2CYP4F2
Acetic Acid SCHEMBL3156541 1.00 GAA (0.56) GAAMGAMSIMGAM2CYP4F2
Acetic Acid SCHEMBL413364 1.00 GAA (0.56) GAAMGAMSIMGAM2CYP4F2
Acetic Acid SCHEMBL6311569 1.00 GAA (0.56) GAAMGAMSIMGAM2CYP4F2
Acetic Acid SCHEMBL8521751 1.00 GAA (0.56) GAAMGAMSIMGAM2CYP4F2
Acetic Acid SCHEMBL146529 1.00 GAA (0.56) GAAMGAMSIMGAM2CYP4F2
Acetic Acid SCHEMBL370017 1.00 GAA (0.56) GAAMGAMSIMGAM2CYP4F2
Acetic Acid SCHEMBL787505 1.00 GAA (0.56) GAAMGAMSIMGAM2CYP4F2
Acetic Acid SCHEMBL1080927 1.00 GAA (0.56) GAAMGAMSIMGAM2CYP4F2
Acetic Acid SCHEMBL988151 1.00 GAA (0.56) GAAMGAMSIMGAM2CYP4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118324715-A Compounds, compositions, and methods of use thereof 艾勒维生技公司 2024-07-12 CN disclosed
US-20240173267-A1 COMPOUNDS, COMPOSITIONS, AND METHODS OF USING THEREOF ONCORUS, INC. (US) 2024-05-30 US disclosed
CN-117750962-A Compounds, compositions, and methods of use thereof 艾勒维生技公司 2024-03-22 CN disclosed
CN-113423709-B Triazinone imidazole compound and medical application thereof 四川科伦博泰生物医药股份有限公司 2024-02-09 CN disclosed
CN-113087718-B Thienopyrimidinone compounds and medical application thereof 四川科伦博泰生物医药股份有限公司 2024-02-09 CN disclosed
EP-4291201-A1 COMPOUNDS, COMPOSITIONS, AND METHODS OF USING THEREOF Oncorus, Inc. (US) 2023-12-20 EP disclosed
US-20230331724-A1 PROCESSES FOR PREPARING A DIAZABICYCLOOCTANE COMPOUND MEIJI SEIKA PHARMA CO., LTD. (JP) 2023-10-19 US disclosed
WO-2023180189-A1 MPRO TARGETING ANTIVIRAL COMPOUNDS EXSCIENTIA AI LIMITED (GB) 2023-09-28 WO disclosed
US-11731971-B2 Processes for preparing a diazabicyclooctane compound MEIJI SEIKA PHARMA CO., LTD. (JP) 2023-08-22 US disclosed
CN-116354927-A HDAC degradation agent using alkane or fatty acid as connecting chain, preparation method and application thereof 杭州医学院 2023-06-30 CN disclosed
CN-102675367-A Compound containing phosphorus oxy group and pyridine unit and preparation method thereof DONGGUAN CAIXIAN ORGANIC LIGHT EMITTING TECHNOLOGY CO LTD 2012-09-19 CN disclosed
US-20100256333-A1 Peptide-Based Beta Turn Mimetics UNIVERSITY OF MANITOBA (CA) 2010-10-07 US disclosed
CN-1314673-C Multidentate oxazoline ligand having chirality and its compounding product with main group metal or transition metal, synthesis method and its use SHHANGHAI INST OF ORGANIC CHEM (CN) 2007-05-09 CN disclosed
CN-1513847-A Multidentate oxazoline ligand having chirality and its compounding product with main group metal or transition metal, synthesis method and its use 中国科学院上海有机化学研究所 2004-07-21 CN disclosed
US-6642237-B1 Inhibitors of HIV protease and inhibitors of HIV replication, used in the prevention or treatment of infection by HIV and treatment for AIDS MERCK & CO., INC. 2003-11-04 US disclosed
EP-0970071-A1 2-PEPERAZINONE-1-ACETIC ACID DERIVATIVES AND THEIR USE Takeda Chemical Industries, Ltd. (JP) 2000-01-12 EP disclosed
CN-1218460-A Substituted 4-hydroxy-phenylalcanoic acid derivatives with activity to ppar-'gamma' GLAXO GROUP LTD (GB) 1999-06-02 CN disclosed
WO-1998039324-A1 2-PEPERAZINONE-1-ACETIC ACID DERIVATIVES AND THEIR USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-09-11 WO disclosed
US-5389663-A Fungicides TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-02-14 US disclosed
EP-0510700-A2 Azole compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-10-28 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 (4 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-11731971-B2 Processes for preparing a diazabicyclooctane compound FN1, BMP1, AZI2 GAA 3749/4885MGAM 4534/4885SI 2970/4885
US-20100256333-A1 Peptide-Based Beta Turn Mimetics VIP, PTMA, PREP GAA 3329/4885MGAM 3661/4885SI 221/4885
US-20240173267-A1 COMPOUNDS, COMPOSITIONS, AND METHODS OF USING THEREOF POLRMT, POLN, NSUN2 GAA 917/4885MGAM 3922/4885SI 3128/4885
US-20230331724-A1 PROCESSES FOR PREPARING A DIAZABICYCLOOCTANE COMPOUND FN1, BMP1, AZI2 GAA 3749/4885MGAM 4534/4885SI 2970/4885

“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.