Acetic Acid

Acetic Acid

SCHEMBL910582

CC(=O)O.N=C(N)N[C@H](CCC(=O)O)C(=O)O

nearest known ligand 0.58

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 9)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 8/20 0.58
NAALAD2 Q9Y3Q0 4/20 0.58
RIMKLA Q8IXN7 1/20 0.58
GGH Q92820 1/20 0.46
FNTA P49354 2/20 0.44
FNTB P49356 2/20 0.44
GNPAT O15228 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 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
SCHEMBL910273 0.94 FOLH1 (0.64) FOLH1NAALAD2RIMKLAGGHGNPAT
SCHEMBL910175 0.94 FOLH1 (0.64) FOLH1NAALAD2RIMKLAGGHGNPAT
SCHEMBL910174 0.94 FOLH1 (0.64) FOLH1NAALAD2RIMKLAGGHGNPAT
SCHEMBL910360 0.94 FOLH1 (0.64) FOLH1NAALAD2RIMKLAGGHGNPAT
SCHEMBL910607 0.93 FOLH1 (0.62) FOLH1NAALAD2RIMKLAGGHGNPAT
Hydrochloric Acid SCHEMBL910549 0.93 FOLH1 (0.62) FOLH1NAALAD2RIMKLAGGHGNPAT
Oxalic Acid SCHEMBL910834 0.91 FOLH1 (0.60) FOLH1NAALAD2RIMKLAGGHGNPAT
Succinic Acid SCHEMBL911170 0.91 FOLH1 (0.60) FOLH1NAALAD2RIMKLAGGHGNPAT
Sulfuric Acid SCHEMBL910205 0.88 FOLH1 (0.56) FOLH1NAALAD2RIMKLAGGHGNPAT
Maleic Acid SCHEMBL910784 0.86 FOLH1 (0.55) FOLH1NAALAD2RIMKLAGNPATCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110004019-A1 Parakeratosis Inhibitor, Pore-Shrinking Agent, Or Rough Skin Inhibiting/Ameliorating Agent, And External Composition For Skin Containing The Same SHISEIDO COMPANY LTD. (JP) 2011-01-06 US disclosed
EP-2255780-A1 PARAKERATOSIS INHIBITOR, PORE SHRINKING AGENT OR AGENT FOR PREVENTING OR IMPROVING ROUGH SKIN, AND COMPOSITION FOR EXTERNAL USE ON THE SKIN CONTAINING THE SAME Shiseido Company, Ltd. (JP) 2010-12-01 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 (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-20110004019-A1 Parakeratosis Inhibitor, Pore-Shrinking Agent, Or Rough Skin Inhibiting/Ameliorating Agent, And External Composition For Skin Containing The Same CUTA, GLRA3, ARGLU1 FOLH1 4099/4885NAALAD2 1692/4885RIMKLA 881/4885

“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.