Oxalic Acid

Oxalic Acid

SCHEMBL6502777

N#Cc1cc(F)c(Cl)cc1OC(CCN)c1cccnc1.O=C(O)C(=O)O

nearest known ligand 0.80

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 8)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 11/20 0.80
NOS2 P35228 13/20 0.80
SLC6A2 P23975 11/20 0.80
CYP2D6 P10635 10/20 0.80
KCNH2 Q12809 2/20 0.40
MRGPRX4 Q96LA9 1/20 0.39
S1PR1 P21453 1/20 0.35
S1PR3 Q99500 1/20 0.35

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
SCHEMBL6500286 0.94 NOS2 (0.76) NOS2SLC6A4SLC6A2CYP2D6KCNH2
Oxalic Acid SCHEMBL6491974 0.89 SLC6A4 (0.64) NOS2SLC6A4SLC6A2CYP2D6KCNH2
Oxalic Acid SCHEMBL6491911 0.89 NOS2 (1.00) NOS2SLC6A4SLC6A2CYP2D6KCNH2
SCHEMBL28116844 0.84 SLC6A4 (1.00) NOS2SLC6A4SLC6A2CYP2D6KCNH2
SCHEMBL231999 0.84 SLC6A4 (1.00) NOS2SLC6A4SLC6A2CYP2D6KCNH2
Oxalic Acid SCHEMBL6576527 0.83 NOS2 (0.70) NOS2SLC6A4SLC6A2CYP2D6KCNH2
SCHEMBL6489564 0.83 SLC6A4 (0.59) NOS2SLC6A4SLC6A2CYP2D6KCNH2
SCHEMBL6748032 0.82 NOS2 (0.55) NOS2SLC6A4SLC6A2CYP2D6KCNH2
Hydrochloric Acid SCHEMBL6855347 0.81 NOS2 (0.54) NOS2SLC6A4SLC6A2CYP2D6KCNH2
Hydrochloric Acid SCHEMBL6855357 0.81 NOS2 (0.54) NOS2SLC6A4SLC6A2CYP2D6KCNH2

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
US-6887871-B2 Use of phenylheteroakylamine derivatives ASTRAZENECA AB (SE) 2005-05-03 US disclosed
EP-1263711-B1 NOVEL USE OF PHENYLHETEROALKYLAMINE DERIVATIVES ASTRAZENECA AB (SE) 2004-12-15 EP disclosed
US-20030158185-A1 Novel use of phenylheteroakylamine derivatives ASTRAZENECA AB (SE) 2003-08-21 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-20030158185-A1 Novel use of phenylheteroakylamine derivatives NOS1, XDH, NOS2 SLC6A4 2468/4885NOS2 3/4885SLC6A2 1776/4885

“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.