Oxalic Acid

Oxalic Acid

SCHEMBL4381733

CNC(CC(C)C)C(=O)N1CCC(=NOCc2ccnc(Cl)c2)CC1.O=C(O)C(=O)O

nearest known ligand 0.36

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 20)

geneUniProtsupporting neighboursconfidence
CTSK P43235 7/20 0.36
CTSL P07711 5/20 0.36
CTSS P25774 4/20 0.36
CTSB P07858 3/20 0.36
CYP3A4 P08684 1/20 0.36
UGCG Q16739 1/20 0.36
CCR1 P32246 2/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
CACNA1B Q00975 1/20 0.33
PDE5A O76074 1/20 0.32
HRH1 P35367 1/20 0.32
SLC6A15 Q9H2J7 1/20 0.32
MMP1 P03956 2/20 0.32
ADAM17 P78536 1/20 0.32
MAPK1 P28482 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GAA P10253 1/20 0.32

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
Oxalic Acid SCHEMBL4381726 1.00 CTSK (0.36) CTSKCTSLCTSSCTSBCYP3A4
SCHEMBL13588922 0.97 CYP3A4 (0.37) CTSKCTSLCTSSCTSBCYP3A4
Oxalic Acid SCHEMBL4390158 0.87 CTSK (0.39) CTSKCTSLCTSSCTSBCACNA1B
Oxalic Acid SCHEMBL4390155 0.87 CTSK (0.39) CTSKCTSLCTSSCTSBCACNA1B
SCHEMBL13588919 0.84 CTSK (0.39) CTSKCTSLCTSSCTSBCACNA1B
SCHEMBL13588925 0.83 CTSS (0.44) CTSKCTSLCTSSCTSBCCR1
Hydrochloric Acid SCHEMBL4384721 0.83 CTSS (0.43) CTSKCTSLCTSSCTSBCCR1
Hydrochloric Acid SCHEMBL4384724 0.83 CTSS (0.43) CTSKCTSLCTSSCTSBCCR1
SCHEMBL13588918 0.82 CYP2C19 (0.44) CTSKCTSLCTSSCTSBCYP3A4
SCHEMBL13588914 0.82 CTSK (0.48) CTSKCTSLCTSSCTSBCACNA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 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-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF KCNN4, CACNA1A, KCNN3 CTSK 3322/4885CTSL 2813/4885CTSS 3208/4885

“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.