Acetic Acid

Acetic Acid

SCHEMBL1844528

CC(=O)O.O=C(O)O.[CaH2]

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 SCHEMBL578078 1.00 FFAR3 (0.78)
Acetic Acid SCHEMBL11766343 1.00 FFAR3 (0.78)
Acetic Acid SCHEMBL20137312 0.95 FFAR3 (0.70)
Acetic Acid SCHEMBL4346329 0.95 FFAR3 (0.70)
Acetic Acid SCHEMBL4217512 0.94 FFAR3 (0.88)
Acetic Acid SCHEMBL8182975 0.94 FFAR3 (0.88)
Acetic Acid SCHEMBL2402511 0.94
Acetic Acid SCHEMBL21084343 0.94 FFAR3 (0.88)
Acetic Acid SCHEMBL586755 0.94
Acetic Acid SCHEMBL18753 0.94

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117229834-A Composite titanium urea grease and preparation method thereof 安徽博洋润滑科技有限公司 2023-12-15 CN disclosed
CN-113860791-B Quick response type concrete self-repairing capsule and preparation method thereof 东南大学 2023-02-28 CN disclosed
CN-113860791-A Quick response type concrete self-repairing capsule and preparation method thereof 东南大学 2021-12-31 CN disclosed
CN-102604716-B Excellent carbamido lubricating grease composition with shear stability and preparation method thereof HANGZHOU DERUNBAO GREASE CO LTD 2015-06-17 CN disclosed
US-8288416-B2 Substituted piperidinophenyl oxazolidinones WOCKHARDT LTD. (IN) 2012-10-16 US disclosed
EP-2069339-B1 SUBSTITUTED PIPERIDINOPHENYL OXAZOLIDINONES WOCKHARDT RESEARCH CENTER (IN) 2011-05-18 EP disclosed
US-20100120721-A1 SUBSTITUTED PIPERIDINOPHENYL OXAZOLIDINONES WOCKHARDT RESEARCH CENTRE (IN) 2010-05-13 US disclosed
EP-2069339-A2 SUBSTITUTED PIPERIDINOPHENYL OXAZOLIDINONES Wockhardt Research Centre (IN) 2009-06-17 EP disclosed
WO-2008038092-A2 SUBSTITUTED PIPERIDINOPHENYL OXAZOLIDINONES WOCKHARDT RESEARCH CENTRE (IN) 2008-04-03 WO disclosed