Oxalic Acid

Oxalic Acid

SCHEMBL5863149

CN(C)CCN.O=C(O)C(=O)O

nearest known ligand 0.39

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
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
KDM4E B2RXH2 9/20 0.37
ALDH1A1 P00352 8/20 0.37
MAPT P10636 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRNB2 P17787 1/20 0.36
CHRM3 P20309 1/20 0.36
CHRNA4 P43681 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
GABRR1 P24046 2/20 0.33
LMNA P02545 1/20 0.33
GLRA1 P23415 1/20 0.33
SLC6A9 P48067 1/20 0.33
OR51E2 Q9H255 1/20 0.33
GAA P10253 1/20 0.33

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
Bicarbonate SCHEMBL30077198 0.92 CYP2C9 (0.40) CYP2C9CYP2C19ALDH1A1MAPTCHRM2
Acetic Acid SCHEMBL29175008 0.89 FFAR3 (0.39) CYP2C9CYP2C19MAPTCHRM2CHRM4
Carbamic Acid SCHEMBL5488417 0.89 ACHE (0.39) CYP2C9CYP2C19ALDH1A1MAPTCHRM2
Acetic Acid SCHEMBL7124420 0.89 FFAR3 (0.39) CYP2C9CYP2C19MAPTCHRM2CHRM4
Acetic Acid SCHEMBL3578727 0.89 FFAR3 (0.39) CYP2C9CYP2C19MAPTCHRM2CHRM4
Acetic Acid SCHEMBL11467288 0.86 CYP2C9 (0.37) CYP2C9CYP2C19MAPTCHRM2CHRM4
Urea SCHEMBL4966379 0.86 CYP2C9 (0.40) CYP2C9CYP2C19ALDH1A1MAPTCHRM2
Methacrylic Acid SCHEMBL17453355 0.85 TDP1 (0.36) CYP2C9CYP2C19KDM4EALDH1A1MAPT
Propionic Acid SCHEMBL7118905 0.84 FFAR3 (0.50) CYP2C9CYP2C19MAPTCHRM2CHRM4
Oxalic Acid SCHEMBL5863172 0.84 TDP1 (0.48) CYP2C9CYP2C19KDM4EALDH1A1CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7132456-B2 MCH receptor antagonists ELI LILLY AND COMPANY (US) 2006-11-07 US claimed
US-20060052449-A1 Novel mch receptor antagonists ELI LILLY AND COMPANY 2006-03-09 US claimed
EP-1572637-A1 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2005-09-14 EP claimed
WO-2004052848-A1 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2004-06-24 WO claimed
US-7132456-B2 MCH receptor antagonists ELI LILLY AND COMPANY (US) 2006-11-07 US disclosed
US-20060052449-A1 Novel mch receptor antagonists ELI LILLY AND COMPANY 2006-03-09 US disclosed
EP-1572637-A1 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2005-09-14 EP disclosed
WO-2004052848-A1 NOVEL MCH RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2004-06-24 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-20060052449-A1 Novel mch receptor antagonists MCHR1, MCHR2, MC1R CYP2C9 3250/4885CYP2C19 2599/4885KDM4E 2532/4885

“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.