Acetic Acid

Acetic Acid

SCHEMBL17477064

CC(=O)O.CNN(C)C(=O)c1cc(Br)cc(Br)c1NC(=O)c1cc(Br)nn1-c1ncccc1Cl

nearest known ligand 0.57

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 5)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.38
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ LMNA P02545 1/20 0.30
▸ NTRK1 P04629 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
SCHEMBL949995 0.97 DHODH (0.39) DHODHMEN1KMT2ALMNA
SCHEMBL14698541 0.91 DHODH (0.41) DHODHMEN1KMT2ALMNANTRK1
SCHEMBL12911779 0.91 DHODH (0.38) DHODHMEN1KMT2ALMNA
SCHEMBL10028784 0.90 DHODH (0.41) DHODHMEN1KMT2ALMNANTRK1
SCHEMBL951388 0.89 DHODH (0.40) DHODHMEN1KMT2ALMNANTRK1
SCHEMBL13072418 0.89 DHODH (0.38) DHODHMEN1KMT2ALMNANTRK1
SCHEMBL12528079 0.88 DHODH (0.39) DHODHMEN1KMT2ALMNA
SCHEMBL17750084 0.88 DHODH (0.39) DHODHMEN1KMT2ALMNANTRK1
SCHEMBL15741755 0.88 DHODH (0.40) DHODHMEN1KMT2ALMNANTRK1
SCHEMBL120823 0.88 DHODH (0.39) DHODHMEN1KMT2A

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
EP-2967063-B1 LAWN GROWTH-PROMOTING AGENT AND METHOD OF USING SAME BAYER CROPSCIENCE AG (DE) 2017-10-18 — — EP disclosed
US-20160029629-A1 LAWN GROWTH-PROMOTING AGENT AND METHOD OF USING SAME BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-02-04 — — 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 (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-20160029629-A1 LAWN GROWTH-PROMOTING AGENT AND METHOD OF USING SAME FGF2, FGF1, MKI67 DHODH 542/4885MEN1 835/4885KMT2A 689/4885

“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.

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