Acetic Acid

Acetic Acid

SCHEMBL25282953

CC(=O)O.NCCCN1CCCC1=O

nearest known ligand 0.50

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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.

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
KMT2A Q03164 4/20 0.49
RAB9A P51151 3/20 0.45
NPC1 O15118 2/20 0.45
PIK3CD O00329 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL56994 0.89 TSHR (0.50) TSHRKMT2APIK3CD
Ammonia Solution, Strong SCHEMBL1579461 0.88 TSHR (0.48) TSHRKMT2APIK3CD
Water SCHEMBL27492735 0.88 TSHR (0.48) TSHRKMT2APIK3CD
SCHEMBL1447146 0.84 TSHR (0.44) TSHRKMT2ARAB9APIK3CDSMN1; SMN2
SCHEMBL4401518 0.84 TSHR (0.48) TSHRKMT2APIK3CD
SCHEMBL7933852 0.82 TSHR (0.47) TSHRKMT2APIK3CD
SCHEMBL7933198 0.82 TSHR (0.47) TSHRKMT2APIK3CD
Hydrochloric Acid SCHEMBL4056528 0.82 TSHR (0.43) TSHRKMT2ARAB9APIK3CDSMN1; SMN2
SCHEMBL3512713 0.82 L3MBTL1 (0.46) TSHRKMT2ARAB9APIK3CDSMN1; SMN2
SCHEMBL28060890 0.82 TSHR (0.47) TSHRKMT2APIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3990899-B1 QUANTITATIVE RAMAN SPECTROSCOPY AALTO UNIV FOUNDATION SR (FI) 2026-05-20 EP disclosed
US-12571737-B2 Quantitative Raman spectroscopy AALTO UNIVERSITY FOUNDATION SR (FI) 2026-03-10 US disclosed
US-12509801-B2 Recycling of acid-superbase conjugate ionic liquids by water removal in the lyocell spinning process AALTO UNIVERSITY FOUNDATION SR (FI) 2025-12-30 US disclosed
US-20230203717-A1 Recycling of acid-superbase conjugate ionic liquids by water removal in the lyocell spinning process AALTO UNIVERSITY FOUNDATION SR (FI) 2023-06-29 US disclosed
US-20220364997-A1 QUANTITATIVE RAMAN SPECTROSCOPY AALTO UNIVERSITY FOUNDATION SR (FI) 2022-11-17 US disclosed
EP-3990899-A1 QUANTITATIVE RAMAN SPECTROSCOPY Aalto University Foundation sr (FI) 2022-05-04 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12571737-B2 Quantitative Raman spectroscopy CWC22, ILF2, IL36G TSHR 4455/4885KMT2A 4487/4885RAB9A 4182/4885
US-12509801-B2 Recycling of acid-superbase conjugate ionic liquids by water removal in the lyocell spinning process SDC1, SDC2, CWC15 TSHR 4076/4885KMT2A 3899/4885RAB9A 562/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.