Acetic Acid

Acetic Acid

SCHEMBL5069778

CC(=O)O.CC(=O)O.CC(=O)O.CCO[Si](OCC)(OCC)C(CC)NCCN

nearest known ligand 0.32

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 4)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 3/20 0.32
GGT1 P19440 1/20 0.32
CPB1 P15086 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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 SCHEMBL1953730 0.98 CPB2 (0.32) CPB2GGT1CPB1
SCHEMBL199875 0.90
Acetic Acid SCHEMBL22342078 0.85 CPB2 (0.33) CPB2GGT1CPB1
Acetic Acid SCHEMBL896270 0.85 CPB2 (0.33) CPB2GGT1CPB1
Acetic Acid SCHEMBL896859 0.84 CPB2 (0.32) CPB2GGT1CPB1
Acetic Acid SCHEMBL2347225 0.84 CPB2 (0.32) CPB2GGT1CPB1
Acetic Acid SCHEMBL28616089 0.84 CPB2 (0.32) CPB2GGT1CPB1
SCHEMBL477661 0.80 CA12 (0.38) ALDH1A1
SCHEMBL11741158 0.80
SCHEMBL10891054 0.78 LMNA (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3137485-A1 CHELATOR MODIFIED MAGNETIC SILICA NANOPARTICLES, THEIR USE AND PREPARATION Universidade de Aveiro (PT) 2017-03-08 EP claimed
WO-2015166415-A1 CHELATOR MODIFIED MAGNETIC SILICA NANOPARTICLES, THEIR USE AND PREPARATION UNIVERSIDADE DE AVEIRO (PT) 2015-11-05 WO claimed
EP-3137485-A1 CHELATOR MODIFIED MAGNETIC SILICA NANOPARTICLES, THEIR USE AND PREPARATION Universidade de Aveiro (PT) 2017-03-08 EP disclosed
WO-2015166415-A1 CHELATOR MODIFIED MAGNETIC SILICA NANOPARTICLES, THEIR USE AND PREPARATION UNIVERSIDADE DE AVEIRO (PT) 2015-11-05 WO disclosed
US-7361275-B2 Use of derivatized nanoparticles to minimize growth of micro-organisms in hot filled drinks EASTMAN KODAK COMPANY (US) 2008-04-22 US disclosed
US-7357979-B2 Composition of matter comprising polymer and derivatized nanoparticles EASTMAN KODAK COMPANY (US) 2008-04-15 US disclosed
WO-2006075995-A2 ARTICLE INHIBITING MICROBIAL GROWTH IN PHYSIOLOGICAL FLUIDS EASTMAN KODAK COMPANY (US) 2006-07-20 WO disclosed
WO-2005111129-A2 COMPOSITION COMPRISING POLYMER AND DERIVATIZED NANOPARTICLES EASTMAN KODAK COMPANY (US) 2005-11-24 WO disclosed
WO-2005107501-A2 ARTICLE FOR INHIBITING MICROBIAL GROWTH EASTMAN KODAK COMPANY (US) 2005-11-17 WO disclosed
WO-2005099489-A2 MINIMIZING GROWTH OF MICRO-ORGANISMS IN LIQUID NUTRIENTS BY LIMITATION OF ESSENTIAL METAL IONS EASTMAN KODAK COMPANY (US) 2005-10-27 WO disclosed
US-20050226913-A1 Article for inhibiting microbial growth in physiological fluids EASTMAN KODAK COMPANY 2005-10-13 US disclosed
US-20050224419-A1 Use of derivatized nanoparticles to minimize growth of micro-organisms in hot filled drinks EASTMAN KODAK COMPANY 2005-10-13 US disclosed
US-20050228099-A1 Composition of matter comprising polymer and derivatized nanoparticles EASTMAN KODAK COMPANY 2005-10-13 US disclosed
US-20050224417-A1 Use of derivatized nanoparticles to minimize growth of micro-organisms in hot filled drinks EASTMAN KODAK COMPANY 2005-10-13 US disclosed
US-20050226911-A1 Article for inhibiting microbial growth in physiological fluids EASTMAN KODAK COMPANY 2005-10-13 US disclosed
US-20050226967-A1 Article for inhibiting microbial growth EASTMAN KODAK COMPANY 2005-10-13 US disclosed
US-20050224416-A1 Use of derivatized nanoparticles to minimize growth of micro-organisms in hot filled drinks NPEC INC. 2005-10-13 US 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-20050226913-A1 Article for inhibiting microbial growth in physiological fluids FABP2, FABP1, MIF CPB2 439/4885GGT1 839/4885CPB1 635/4885
US-20050226911-A1 Article for inhibiting microbial growth in physiological fluids FABP2, FABP1, FABP6 CPB2 243/4885GGT1 889/4885CPB1 313/4885

“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.