Acetic Acid

Acetic Acid

SCHEMBL7894019

CC(=O)O.NC(N)=S

nearest known ligand 0.00

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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 SCHEMBL27528692 0.92
Acetic Acid SCHEMBL3803565 0.92 FFAR3 (0.58)
Acetic Acid SCHEMBL2186621 0.92 FFAR3 (0.58)
Acetic Acid SCHEMBL6618956 0.92
Acetic Acid SCHEMBL27989360 0.89 FFAR3 (0.47)
Acetic Acid SCHEMBL10637144 0.88 FFAR3 (0.54)
Acetic Acid SCHEMBL11680279 0.88 FFAR3 (0.54)
Acetic Acid SCHEMBL10775531 0.88 FFAR3 (0.54)
Acetic Acid SCHEMBL28163768 0.88 FFAR3 (0.54)
Acetic Acid SCHEMBL28163833 0.88 FFAR3 (0.54)

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117401835-A Soft water corrosion inhibitor for closed circulating water system and preparation method thereof 山东天庆科技发展有限公司 2024-01-16 CN claimed
CN-117401835-A Soft water corrosion inhibitor for closed circulating water system and preparation method thereof 山东天庆科技发展有限公司 2024-01-16 CN disclosed
CN-110438168-B Method for synthesizing xylitol by utilizing bagasse biocatalysis 浙江金晟环保股份有限公司 2021-09-14 CN disclosed
CN-108483605-B Preparation method of modified natural polysaccharide heavy metal chelating and trapping flocculant 南京工业大学 2021-06-01 CN disclosed
CN-107899555-B Preparation and application of composite adsorbing material for removing heavy metals Mo (VI) in water body 安徽工业大学 2020-05-01 CN disclosed
US-6177099-B1 SITE SPECIFIC DELIVERY OF THE LIPOSOME'S CARGO BY USING BOTH RETICULOENDOTHELIAL SYSTEM (RES)-AVOIDANCE NEURAMINIC ACID OR DERIVATIVES THAT CANNOT BE CLEAVED BY ENDOGENOUS ENZYMES WITH SITE-SPECIFIC MOLECULES SUCH AS MONOCLONAL ANTIBODIES SDG, INC. 2001-01-23 US disclosed
EP-0918508-A1 IMPROVED MASKING OF LIPOSOMES FROM RES RECOGNITION SDG, INC. (US) 1999-06-02 EP disclosed
WO-1997039735-A1 IMPROVED MASKING OF LIPOSOMES FROM RES RECOGNITION SDG, INC. (US) 1997-10-30 WO disclosed
US-5567432-A MEMBRANE ENCAPSULATED BY SYNTHETIC NEUMAMINIC ACID RESIDUE;RETICULOENDOTHELIAL SYSTEM SDG, INC. 1996-10-22 US disclosed
US-4997494-A Dry particles ICI CANADA INC. (CA) 1991-03-05 US disclosed