Acetic Acid

Acetic Acid

SCHEMBL515499

CC(=O)O.COC(C)[Hg]

nearest known ligand 0.00

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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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 SCHEMBL31320733 0.83
Acetic Acid SCHEMBL297447 0.80
Acetic Acid SCHEMBL10711426 0.80 FFAR3 (0.47)
Acetic Acid SCHEMBL27732782 0.78
Acetic Acid SCHEMBL27297978 0.76 FFAR3 (0.50)
Acetic Acid SCHEMBL28284893 0.76 FFAR3 (0.50)
Acetic Acid SCHEMBL29066114 0.75 FFAR3 (0.41)
Hydrochloric Acid SCHEMBL4621155 0.73
Acetic Acid SCHEMBL9576440 0.73 FFAR3 (0.70)
Acetic Acid SCHEMBL16230 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103874413-B 5-fluoro-4-imino-3- (substituted) -3, 4-dihydropyrimidin-2 (1H) one derivatives 阿达玛马克西姆股份有限公司 2017-03-08 CN claimed
EP-4284173-A1 5-FLUORO-4-IMINO-3-METHYL-1-TOSYL-3,4-DIHYDROPYRIMIDIN-2(1 H)-ONE FOR CONTROLLING PLANT DISEASES ADAMA MAKHTESHIM LTD. (IL) 2023-12-06 EP disclosed
CN-112005408-A Redox and ion adsorption electrode and energy storage device 加利福尼亚大学董事会 2020-11-27 CN disclosed
CN-110352006-A PICOLINAMIDES AS FUNGICIDES 美国陶氏益农公司 2019-10-18 CN disclosed
CN-109996443-A The purposes of two fluoro- fungicides of (2- hydroxypropyl) pyridine compounds as the plant pathogenic fungi for preventing and treating wheat 美国陶氏益农公司 2019-07-09 CN disclosed
CN-109982566-A Fungicidal compounds and mixture for fungus control in cereal 美国陶氏益农公司 2019-07-05 CN disclosed
CN-109982565-A Fungicidal compounds and mixture for fungus control in cereal 美国陶氏益农公司 2019-07-05 CN disclosed
CN-108697086-A Synergistic fungicidal mixtures for the fungal control of rice blast 美国陶氏益农公司 2018-10-23 CN disclosed
CN-105409971-B Synergistic Fungicidal mixture for the fungi control in cereal 陶氏益农公司 2018-08-14 CN disclosed
CN-107074799-A It is used as the big ring picolinamide of fungicide 美国陶氏益农公司 2017-08-18 CN disclosed
CN-106456601-A Macrocyclic picolinamides as fungicides 美国陶氏益农公司 2017-02-22 CN disclosed
CN-106231901-A Metal enzyme inhibitor compound as antifungal 美国陶氏益农公司 2016-12-14 CN disclosed
CN-106061256-A Macrocyclic picolinamide compounds having fungicidal activity 美国陶氏益农公司 2016-10-26 CN disclosed
CN-106061257-A Use of macrocyclic picolinamides as fungicides 美国陶氏益农公司 2016-10-26 CN disclosed
US-20120027824-A1 Preparations facilitated by vesicles using alkyl polypentosides and uses of said preparations AGRO INDUSTRIE RECHERCHES ET DEVELOPPEMENT (A.R.D.) (FR) 2012-02-02 US disclosed
US-20060276339-A1 Methods and compositions for increasing the efficacy of biologically-active ingredients BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2006-12-07 US disclosed
US-5044116-A With low melting polyester and peroxy compound INTEROX (SOCIETE ANONYME) (BE) 1991-09-03 US disclosed
US-4879839-A POLYCAPROLACTONE SOLVAY & CIE. (SOCIETE ANONYME) (BE) 1989-11-14 US disclosed
US-4735017-A POLYLACTONES; STORAGE STABILITY SOLVAY & CIE (SOCIETE ANONYME) (BE) 1988-04-05 US disclosed
US-4164582-A METHYLBENZIMIDAZOLE-2-YLCARBAMATE AND 1-(B-(ALLYLOXY)-2,4-DICHLOROPHENETHYL)IMIDAZOLE KEMIRA OY (FI) 1979-08-14 US disclosed