Acetic Acid

Acetic Acid

SCHEMBL87553

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

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 12)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.50
LCK P06239 1/20 0.50
FYN P06241 1/20 0.50
TSHR P16473 3/20 0.47
TP53 P04637 1/20 0.39
HCAR2 Q8TDS4 1/20 0.36
ALDH1A1 P00352 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.32
SLC7A5 Q01650 1/20 0.32
THPO P40225 1/20 0.31

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 SCHEMBL27469271 1.00 FFAR3 (0.50) FFAR3LCKFYNTSHRTP53
Acetic Acid SCHEMBL8835007 0.97 FFAR3 (0.47) FFAR3LCKFYNTSHRTP53
Acetic Acid SCHEMBL8834547 0.97 FFAR3 (0.47) FFAR3LCKFYNTSHRTP53
Acetic Acid SCHEMBL8834833 0.91 FFAR3 (0.41) FFAR3LCKFYNTSHRTP53
Bicarbonate SCHEMBL28488934 0.89 TSHR (0.42) FFAR3LCKFYNTSHRTP53
Acetone SCHEMBL48978 0.89 TSHR (0.50) FFAR3LCKFYNTSHRTP53
Acetic Acid SCHEMBL7044569 0.88 TSHR (0.39) FFAR3LCKFYNTSHRTP53
Acetone SCHEMBL28124568 0.86 TSHR (0.47) FFAR3LCKFYNTSHRTP53
Acetone SCHEMBL2748125 0.86 TSHR (0.47) FFAR3LCKFYNTSHRTP53
Acetone SCHEMBL29032239 0.86 TSHR (0.47) FFAR3LCKFYNTSHRTP53

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 1010 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106478616-A A kind of crystal form of GPR40 agonist and preparation method thereof 江苏恒瑞医药股份有限公司 2017-03-08 CN claimed
CN-102010381-B Improved preparation method of valsartan SHANDONG NEW TIME PHARMACEUTICAL Co.,Ltd. (CN) 2012-02-08 CN claimed
EP-4397663-A1 6-AMINOPYRAZOLOPYRIMIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF Japan Tobacco, Inc. (JP) 2024-07-10 EP disclosed
CN-115850249-B Triazine derivative with virus proliferation inhibition effect and pharmaceutical composition containing triazine derivative 盐野义制药株式会社 2024-07-02 CN disclosed
CN-112469707-B Preventive or therapeutic agent for spinal muscular atrophy 利伯纳生物科学株式会社 2024-06-21 CN disclosed
US-12012410-B2 Substituted pyrazolo[1,5-a]pyrazines for spinal muscular atrophy REBORNA BIOSCIENCES, INC. (JP) 2024-06-18 US disclosed
EP-3802530-B1 HETEROCYCLIC COMPOUNDS AS CLASS II PHOSPHOINOSITIDE 3-KINASE INHIBITORS FORSCHUNGSVERBUND BERLIN EV (DE) 2024-05-29 EP disclosed
CN-118076620-A Process for producing 2' -modified pyrimidine nucleoside 日产化学株式会社 2024-05-24 CN disclosed
EP-3661923-B1 N-HETEROCYCLIC COMPOUNDS AS OREXIN 2 AGONISTS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS TAKEDA PHARMACEUTICALS CO (JP) 2024-05-15 EP disclosed
CN-110799190-B Heterocyclic compounds 卡都瑞恩医药有限公司 2024-04-19 CN disclosed
US-11958845-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-04-16 US disclosed
US-4064254-A ANTIARRHYTHMIC AND ANTISEROTONINE AGENTS MEAD JOHNSON & COMPANY (US) 1977-12-20 US disclosed
US-4056526-A ANALGESIC, ANTIPYRETIC, ANTIINFLAMMATORY WARNER-LAMBERT COMPANY (US) 1977-11-01 US disclosed
US-4033981-A ANTIHISTOMINIC, ANTIINFLAMMATORY, SEDATIVES, DIURETICS WARNER-LAMBERT COMPANY (US) 1977-07-05 US disclosed
US-4018793-A ANALGESICS, ANTIINFLAMMATORY, ANTIPYRETICS WARNER-LAMBERT COMPANY (US) 1977-04-19 US disclosed
US-4000143-A ANTIARRHYTHMIC AND ANTISEROTONIN AGENTS MEAD JOHNSON & COMPANY (US) 1976-12-28 US disclosed
US-3992376-A ANTIHISTAMINES, ANTITUSSIVES, SEDATIVES, ANTIINFLAMMATORY AGENTS AND DIURETICS WARNER-LAMBERT COMPANY (US) 1976-11-16 US disclosed
US-3978052-A ANTIHISTAMINIC, ANTITUSSIVE, ANTIINFLAMMATORY, DIURETIC WARNER-LAMBERT COMPANY (US) 1976-08-31 US disclosed
US-3971814-A ANALGESICS, ANTIPYRETICS, ANTIINFLAMMATORY AGENTS WARNER-LAMBERT COMPANY (US) 1976-07-27 US disclosed
US-3953464-A ANALGESICS, ANTIINFLAMMATORY AGENTS WARNER-LAMBERT COMPANY (US) 1976-04-27 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-12012410-B2 Substituted pyrazolo[1,5-a]pyrazines for spinal muscular atrophy SMN1; SMN2, HDAC5, PUM1 FFAR3 3541/4885LCK 4631/4885FYN 3313/4885
US-11958845-B2 Heterocyclic compound HDAC6, HDAC1, HDAC5 FFAR3 4277/4885LCK 2065/4885FYN 343/4885

“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.