Acetic Acid

Acetic Acid

SCHEMBL7817844

CC(=O)O.Cc1cccc2nc(-c3cn(CCCN)c4ccccc34)c(=O)[nH]c12

nearest known ligand 0.48

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.

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 17/20 0.48
PIM1 P11309 1/20 0.46
RPS6KB1 P23443 1/20 0.42
PRKACA P17612 1/20 0.41
PRKACG P22612 1/20 0.41
PRKACB P22694 1/20 0.41

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
Acetic Acid SCHEMBL7817930 0.91 CAMK2D (0.48) CAMK2DPIM1RPS6KB1PRKACAPRKACG
Acetic Acid SCHEMBL7817891 0.90 CAMK2D (0.38) CAMK2DPIM1
Acetic Acid SCHEMBL7815395 0.87 CAMK2D (0.51) CAMK2DPIM1RPS6KB1PRKACAPRKACG
Acetic Acid SCHEMBL7817825 0.86 ASH1L (0.40) CAMK2D
Acetic Acid SCHEMBL7807205 0.86 ITK (0.37) CAMK2D
Acetic Acid SCHEMBL7806990 0.86 PDE4B (0.38) CAMK2D
Acetic Acid SCHEMBL7814560 0.86 PPARG (0.39) CAMK2D
Acetic Acid SCHEMBL7815740 0.85 CAMK2D (0.47) CAMK2DPIM1RPS6KB1PRKACAPRKACG
Acetic Acid SCHEMBL7815650 0.84 CAMK2D (0.48) CAMK2DPIM1RPS6KB1PRKACAPRKACG
Acetic Acid SCHEMBL7807288 0.83 CAMK2D (0.49) CAMK2DPIM1RPS6KB1PRKACAPRKACG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010025043-A1 New pharmaceutical active compounds ASTRA AKTIEBOLAG, A SWEDEN CORPORATION 2001-09-27 US disclosed
US-6271231-B1 Pharmaceutically active compounds ASTRA AKTIEBOLAG (SE) 2001-08-07 US disclosed
EP-0929551-A1 NEW PHARMACEUTICALLY ACTIVE COMPOUNDS Astra Aktiebolag (publ) (SE) 1999-07-21 EP disclosed
WO-1998013368-A1 NEW PHARMACEUTICALLY ACTIVE COMPOUNDS ASTRA AKTIEBOLAG (PUBL) (SE) 1998-04-02 WO 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 (1 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-20010025043-A1 New pharmaceutical active compounds CSNK1A1, CSNK1G1, CSNK2A1 CAMK2D 338/4885PIM1 815/4885RPS6KB1 267/4885

“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.