Oxalic Acid

Oxalic Acid

SCHEMBL6837604

CCOc1ccc2c(c1)nc(C=Cc1ccccc1)n2-c1ccccn1.O=C(O)C(=O)O

nearest known ligand 0.51

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
MAPT P10636 5/20 0.51
RELA Q04206 2/20 0.41
ACSS2 Q9NR19 1/20 0.41
SMN1; SMN2 Q16637 6/20 0.41
TP53 P04637 3/20 0.41
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
PDE10A Q9Y233 1/20 0.40
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
USP2 O75604 2/20 0.40
NPC1 O15118 2/20 0.40
HPGD P15428 2/20 0.40
RAB9A P51151 2/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TUBB4A P04350 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39

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 SCHEMBL6837603 1.00 MAPT (0.51) MAPTRELAACSS2SMN1; SMN2TP53
Oxalic Acid SCHEMBL6838619 0.90 PDE10A (0.47) MAPTRELASMN1; SMN2TP53PDE10A
Oxalic Acid SCHEMBL6838622 0.90 PDE10A (0.47) MAPTRELASMN1; SMN2TP53PDE10A
Oxalic Acid SCHEMBL6838751 0.89 MAPT (0.54) MAPTRELASMN1; SMN2TP53KDM4E
Oxalic Acid SCHEMBL6838749 0.89 MAPT (0.54) MAPTRELASMN1; SMN2TP53KDM4E
Oxalic Acid SCHEMBL6838656 0.88 FGFR1 (0.42) MAPTSMN1; SMN2TP53PDE10AKDM4E
Oxalic Acid SCHEMBL6838653 0.88 FGFR1 (0.42) MAPTSMN1; SMN2TP53PDE10AKDM4E
SCHEMBL6836851 0.84 PDE10A (0.48) MAPTRELASMN1; SMN2TP53PDE10A
SCHEMBL6836854 0.84 PDE10A (0.48) MAPTRELASMN1; SMN2TP53PDE10A
Oxalic Acid SCHEMBL6835748 0.82 POLB (0.46) MAPTRELASMN1; SMN2TP53KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040181062-A1 Benzimidazole cyclooxygenase-2 inhibitor PFIZER INC 2004-09-16 US disclosed
US-6713482-B2 SUCH AS (E)-1-(2-PYRIDYL)-2-STYRYL-1H-BENZIMIDAZOLE; ANTIINFLAMMATORY AND ANALGESIC AGENTS; PROSTAGLANDIN INHIBITORS PFIZER INC. 2004-03-30 US disclosed
US-20030013886-A1 Benzimidazole cyclooxygenase-2 inhibitors OKUMURA YOSHIYUKI (JP) 2003-01-16 US disclosed
EP-0937722-B1 Benzimidazole derivatives as cyclooxygenase-2 inhibitors PFIZER (US) 2002-07-03 EP disclosed
US-6310079-B1 NON-STEROIDAL ANTIINFLAMMATORY AGENTS PFIZER INC. 2001-10-30 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 (2 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-20030013886-A1 Benzimidazole cyclooxygenase-2 inhibitors PTGS1, CBR1, CBR3 MAPT 4772/4885RELA 1544/4885ACSS2 541/4885
US-20040181062-A1 Benzimidazole cyclooxygenase-2 inhibitor PTGS1, CBR1, CBR3 MAPT 4736/4885RELA 1607/4885ACSS2 564/4885

“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.