Acetic Acid

Acetic Acid

SCHEMBL31447465

CC(=O)O.O=CB(O)O

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
SCHEMBL1948103 0.80
Acetic Acid SCHEMBL30143341 0.76 FFAR3 (0.70)
Acetic Acid SCHEMBL5962982 0.76 FFAR3 (0.70)
Acetic Acid SCHEMBL2259463 0.76
Acetic Acid SCHEMBL7130291 0.76 FFAR3 (0.70)
Acetic Acid SCHEMBL1022741 0.76
Acetic Acid SCHEMBL10940719 0.72 FFAR3 (0.64)
Acetic Acid SCHEMBL10680248 0.72 FFAR3 (0.64)
Acetic Acid SCHEMBL16039739 0.72
Acetic Acid SCHEMBL2026445 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119505509-A Flame-retardant polycarbonate composite material and preparation method thereof 北京理工大学 2025-02-25 CN disclosed