Oxalic Acid

Oxalic Acid

SCHEMBL5111815

CN(C)Cc1ccc(CN)o1.O=C(O)C(=O)O

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

OPRM1SLC6A4

The experimentally established mechanism targets of Oxalic 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
ACHE P22303 16/20 0.50
PRMT6 Q96LA8 1/20 0.50
BCHE P06276 10/20 0.47
SMYD3 Q9H7B4 1/20 0.43
ALOX5 P09917 1/20 0.40

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
SCHEMBL3453519 0.89 ACHE (0.61) ACHEPRMT6BCHE
Oxalic Acid SCHEMBL10370396 0.82 ACHE (0.50) ACHEPRMT6BCHESMYD3
SCHEMBL2458150 0.78 ACHE (0.74) ACHEPRMT6BCHE
SCHEMBL2218079 0.74 TDP1 (0.60) ACHEBCHESMYD3
SCHEMBL3927787 0.73 SMYD3 (0.54) ACHEPRMT6BCHESMYD3ALOX5
SCHEMBL8610492 0.72 ACHE (0.61) ACHEPRMT6BCHE
SCHEMBL1733144 0.72 ACHE (0.61) ACHEPRMT6BCHE
SCHEMBL4162677 0.71 CACNA1G (0.38) ACHEPRMT6ALOX5
Hydrochloric Acid SCHEMBL3081249 0.71 ACHE (0.59) ACHEPRMT6BCHE
SCHEMBL13359173 0.71 CYP2E1 (0.44)

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-7396843-B2 5′-carbamoyl-1,1′-biphenyl-4-carboxamide derivatives and their use as p38 kinase inhibitors GLAXO GROUP LIMITED (GB) 2008-07-08 US disclosed
US-20050038014-A1 5'-carbamoyl-1,1' biphenyl-4-carboxamide derivatives and their use as p38 kinase inhibitors GLAXO GROUP LIMITED (GB) 2005-02-17 US disclosed
EP-1435942-A1 5'-CARBAMOYL-1,1'-BIPHENYL-4-CARBOXAMIDE DERIVATIVES AND THEIR USE AS P38 KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2004-07-14 EP disclosed
WO-2003032980-A1 5'-CARBAMOYL-1,1'-BIPHENYL-4-CARBOXAMIDE DERIVATIVES AND THEIR USE AS P38 KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2003-04-24 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-20050038014-A1 5'-carbamoyl-1,1' biphenyl-4-carboxamide derivatives and their use as p38 kinase inhibitors MAPK1, MAP4K2, MAP3K1 ACHE 2120/4885PRMT6 944/4885BCHE 1963/4885

“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.