Oxalic Acid

Oxalic Acid

SCHEMBL6492884

N#Cc1cc(F)c(Br)cc1O[C@H](CCNCCCO)c1ccoc1.O=C(O)C(=O)O

nearest known ligand 0.46

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 9)

geneUniProtsupporting neighboursconfidence
SLC6A4 known ✓ P31645 13/20 0.46
NOS2 P35228 13/20 0.46
CYP2D6 P10635 10/20 0.46
SLC6A2 P23975 10/20 0.46
KCNH2 Q12809 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL6504032 0.96 NOS2 (0.40) NOS2SLC6A4CYP2D6SLC6A2KCNH2
SCHEMBL7693316 0.96 NOS2 (0.40) NOS2SLC6A4CYP2D6SLC6A2KCNH2
Oxalic Acid SCHEMBL6491863 0.89 SLC6A4 (0.59) NOS2SLC6A4CYP2D6SLC6A2KCNH2
SCHEMBL6492890 0.88 NOS2 (0.40) NOS2SLC6A4CYP2D6SLC6A2KCNH2
Oxalic Acid SCHEMBL6488920 0.85 SLC6A2 (0.46) NOS2SLC6A4CYP2D6SLC6A2KCNH2
SCHEMBL7680237 0.85 SLC6A4 (0.54) NOS2SLC6A4CYP2D6SLC6A2KCNH2
SCHEMBL6491310 0.85 SLC6A4 (0.54) NOS2SLC6A4CYP2D6SLC6A2KCNH2
SCHEMBL6504623 0.80 SLC6A2 (0.40) NOS2SLC6A4CYP2D6SLC6A2KCNH2
SCHEMBL7174582 0.80 SLC6A2 (0.40) NOS2SLC6A4CYP2D6SLC6A2KCNH2
Oxalic Acid SCHEMBL6500140 0.79 NOS2 (0.58) NOS2SLC6A4CYP2D6SLC6A2KCNH2

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
US-6887871-B2 Use of phenylheteroakylamine derivatives ASTRAZENECA AB (SE) 2005-05-03 US 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 3/4885CYP2D6 49/4885

“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.