Acetic Acid

Acetic Acid

SCHEMBL6138982

CC(=O)O.CCCCCCCCCCCCCCCC(=O)NCCCCNC(=N)N

nearest known ligand 0.59

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
CASP2 P42575 1/20 0.59
FAAH O00519 7/20 0.57
EPHX2 P34913 3/20 0.56
NAAA Q02083 1/20 0.56
SLC6A5 Q9Y345 2/20 0.55
DNM1 Q05193 2/20 0.54
KDM4E B2RXH2 1/20 0.49
CNR1 P21554 2/20 0.48
CNR2 P34972 2/20 0.48

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 SCHEMBL2903491 1.00 CASP2 (0.59) CASP2FAAHEPHX2NAAASLC6A5
Acetic Acid SCHEMBL2906531 1.00 CASP2 (0.59) CASP2FAAHEPHX2NAAASLC6A5
Acetic Acid SCHEMBL6940715 1.00 CASP2 (0.59) CASP2FAAHEPHX2NAAASLC6A5
Acetic Acid SCHEMBL6138704 1.00 CASP2 (0.59) CASP2FAAHEPHX2NAAASLC6A5
Acetic Acid SCHEMBL6939789 1.00 CASP2 (0.59) CASP2FAAHEPHX2NAAASLC6A5
Acetic Acid SCHEMBL6139358 1.00 CASP2 (0.59) CASP2FAAHEPHX2NAAASLC6A5
Acetic Acid SCHEMBL6935928 0.97 FAAH (0.57) CASP2FAAHEPHX2NAAASLC6A5
Acetic Acid SCHEMBL6139074 0.97 FAAH (0.57) CASP2FAAHEPHX2NAAASLC6A5
Acetic Acid SCHEMBL6940704 0.95 FAAH (0.56) CASP2FAAHEPHX2NAAASLC6A5
SCHEMBL24087524 0.95 CASP2 (0.65) CASP2FAAHEPHX2NAAASLC6A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1285579-B1 Bactericidal guanidine derivatives, dermally applicable composition, washing composition, and antibacterial fibre aggregate AJINOMOTO KK (JP) 2005-11-02 EP disclosed
US-20030162838-A1 Bactericide, antiseptic, dermally applicable composition, washing composition, antibacterial fiber aggregate, method for eradicating a microorganism, and method for inhibiting the proliferation of a microorgamism AJINOMOTO CO., INC. (JP) 2003-08-28 US disclosed
EP-1285579-A1 Bactericidal guanidine derivatives, dermally applicable composition, washing composition, and antibacterial fibre aggregate Ajinomoto Co., Inc. (JP) 2003-02-26 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-20030162838-A1 Bactericide, antiseptic, dermally applicable composition, washing composition, antibacterial fiber aggregate, method for eradicating a microorganism, and method for inhibiting the proliferation of a microorgamism ARG1, ALKBH1, GANC CASP2 941/4885FAAH 682/4885EPHX2 4570/4885

“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.