Acetic Acid

Acetic Acid

SCHEMBL575053

C1CCOCC1.C1CCOCC1.CC(=O)O

nearest known ligand 0.50

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 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
FFAR3 O14843 2/20 0.44
LCK P06239 1/20 0.44
FYN P06241 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.40
GLA P06280 1/20 0.34
MEN1 O00255 1/20 0.33
TP53 P04637 1/20 0.33
KMT2A Q03164 1/20 0.33
PKM P14618 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GAA P10253 1/20 0.31
LMNA P02545 1/20 0.30
SLC15A2 Q16348 1/20 0.30

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 SCHEMBL4868108 1.00 ALDH1A1 (0.50) ALDH1A1FFAR3LCKFYNSMN1; SMN2
Acetic Acid SCHEMBL29037898 1.00 ALDH1A1 (0.50) ALDH1A1FFAR3LCKFYNSMN1; SMN2
Acetic Acid SCHEMBL2354574 1.00 ALDH1A1 (0.50) ALDH1A1FFAR3LCKFYNSMN1; SMN2
Acetic Acid SCHEMBL10557658 0.97 ALDH1A1 (0.47) ALDH1A1FFAR3LCKFYNSMN1; SMN2
Tetrahydrofuran SCHEMBL44945 0.97
Tetrahydrofuran SCHEMBL1704980 0.97 ALDH1A1 (0.53) ALDH1A1FFAR3LCKFYNSMN1; SMN2
Tetrahydrofuran SCHEMBL28650393 0.97 ALDH1A1 (0.53) ALDH1A1FFAR3LCKFYNSMN1; SMN2
Tetrahydrofuran SCHEMBL7175965 0.94 ALDH1A1 (0.50) ALDH1A1FFAR3LCKFYNSMN1; SMN2
Tetrahydrofuran SCHEMBL7457134 0.94 ALDH1A1 (0.50) ALDH1A1FFAR3LCKFYNSMN1; SMN2
Tetrahydrofuran SCHEMBL7613346 0.94 ALDH1A1 (0.50) ALDH1A1FFAR3LCKFYNSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114181137-A Para-aryl substituted pyridinium derivative electrochromic material and preparation method thereof 黎伟麒 2022-03-15 CN claimed
EP-3841141-B1 A COMPOSITION, PREPARATION METHOD AND APPLICATION THEREOF COVESTRO DEUTSCHLAND AG (DE) 2025-01-01 EP disclosed
US-11965108-B2 Composition, preparation method and application thereof COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2024-04-23 US disclosed
US-11965092-B2 Polyurethane composition, preparation method and application thereof COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2024-04-23 US disclosed
EP-3841139-B1 A POLYURETHANE COMPOSITION, PREPARATION METHOD AND APPLICATION THEREOF COVESTRO INTELLECTUAL PROPERTY GMBH & CO KG (DE) 2023-10-04 EP disclosed
EP-3589677-B1 A COMPOSITION, ITS PRODUCTION AND USE THEREOF COVESTRO DEUTSCHLAND AG (DE) 2023-04-12 EP disclosed
CN-115698179-A Composition and preparation method and application thereof 科思创德国股份有限公司 2023-02-03 CN disclosed
EP-4058523-A1 COMPOSITION, PREPARATION METHOD AND APPLICATION THEREOF Covestro Intellectual Property GmbH & Co. KG (DE) 2022-09-21 EP disclosed
CN-114829516-A Composition and preparation method and application thereof 科思创知识产权两合公司 2022-07-29 CN disclosed
EP-4026877-A1 AN AQUEOUS COATING COMPOSITION AND A PREPARATION PROCESS THEREOF Covestro Deutschland AG (DE) 2022-07-13 EP disclosed
EP-2581374-B1 Preparation of tetrahydropyrido[4,3-b]indole derivatives INST PHARM & TOXICOLOGY AMMS (CN) 2014-03-19 EP disclosed
US-20140030654-A1 PHOTORESIST COMPOSITION AND METHOD FOR PRODUCING PHOTORESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-01-30 US disclosed
EP-2417973-B1 SUSTAINED RELEASE COMPOSITION CONTAINING TETRAHYDROPYRIDO [4, 3-B]INDOLE DERIVATIVE INST PHARM & TOXICOLOGY AMMS (CN) 2013-08-28 EP disclosed
EP-2581374-A1 Preparation of tetrahydropyrido[4,3-b]indole derivatives Institute of Pharmacology and Toxicology Academy of Military Medical Sciences P.L.A. China (CN) 2013-04-17 EP disclosed
US-20120122914-A1 Sustained-release composition containing tetrahydropyrido[4,3-b]indole derivatives and preparation of the derivatives INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCE P.L.A.CHINA (CN) 2012-05-17 US disclosed
EP-2417973-A1 SUSTAINED RELEASE COMPOSITION CONTAINING TETRAHYDROPYRIDO Ý4, 3-b¨INDOLE DERIVATIVE AND PREPARATION METHOD OF DERIVATIVE Institute of Pharmacology and Toxicology Academy of Military Medical Sciences P.L.A. (CN) 2012-02-15 EP disclosed
US-20040162285-A1 Anti-infective agents ABBOTT LABORATORIES 2004-08-19 US disclosed
EP-1305293-A1 HEXAHYDRO-7-IMINO-1H-AZEPIN-2-YL-HEXANOIC ACID DERIVATIVES AS INHIBITORS OF INDUCIBLE NITRIC OXIDE SYNTHASE Pharmacia Corporation (US) 2003-05-02 EP disclosed
WO-2002010139-A1 HEXAHYDRO-7-1H-AZEPIN-2-YL-HAXANOIC ACID DERIVATIVES AS INHIBITORS OF INDUCIBLE NITRIC OXIDE SYNTHASE PHARMACIA CORPORATION (US) 2002-02-07 WO disclosed
US-4258062-A ISOPRENALINE ANTAGONISTS EFFECTING HEART RATE AND BLOOD PRESSURE MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1981-03-24 US 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-20040162285-A1 Anti-infective agents POLR1C, RPL5, POLB ALDH1A1 1434/4885FFAR3 4271/4885LCK 3703/4885
US-20120122914-A1 Sustained-release composition containing tetrahydropyrido[4,3-b]indole derivatives and preparation of the derivatives HTT, HTR5A, HTR3B ALDH1A1 4161/4885FFAR3 1700/4885LCK 1979/4885

“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.