Acetic Acid

Acetic Acid

SCHEMBL5838543

CC(=O)O.O.O.O.[Sm]

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 SCHEMBL94374 1.00
Acetic Acid SCHEMBL27413126 1.00 FFAR3 (0.78)
Acetic Acid SCHEMBL9413749 1.00 FFAR3 (0.78)
Acetic Acid SCHEMBL2944890 1.00
Acetic Acid SCHEMBL4124082 0.94
Acetic Acid SCHEMBL536985 0.94
Acetic Acid SCHEMBL234816 0.94 FFAR3 (0.88)
Acetic Acid SCHEMBL11857925 0.94 FFAR3 (0.88)
Acetic Acid SCHEMBL337441 0.94
Acetic Acid SCHEMBL51762 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7145051-B2 Combined oxydehydrogenation and cracking catalyst for production of olefins EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-12-05 US disclosed
WO-2003082462-A2 COMBINED OXYDEHYDROGENATION AND CRACKING CATALYST FOR PRODUCTION OF OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2003-10-09 WO disclosed
US-20030181325-A1 Combined oxydehydrogenation and cracking catalyst for production of olefins EXXONMOBIL CHEMICAL PATENTS INC. 2003-09-25 US disclosed