Oxalic Acid

Oxalic Acid

SCHEMBL6836384

C(=C/c1nc2ccccc2n1-c1ccccn1)\c1cccnc1.O=C(O)C(=O)O

nearest known ligand 0.54

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
PSD A5PKW4 1/20 0.47
KDM4E B2RXH2 7/20 0.47
MAPT P10636 6/20 0.47
HKDC1 Q2TB90 2/20 0.47
ALDH1A1 P00352 4/20 0.46
KMT2A Q03164 3/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
RAD1 O60671 1/20 0.46
CFTR P13569 1/20 0.46
APEX1 P27695 1/20 0.46
CASP6 P55212 1/20 0.46
RAD51 Q06609 1/20 0.46
GOPC Q9HD26 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NPC1 O15118 5/20 0.44
RAB9A P51151 5/20 0.44
MEN1 O00255 1/20 0.44
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
PKM P14618 2/20 0.41

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 SCHEMBL6836385 1.00 PSD (0.47) PSDKDM4EMAPTHKDC1ALDH1A1
Oxalic Acid SCHEMBL6835801 0.88 KDM4E (0.44) KDM4EMAPTALDH1A1KMT2AL3MBTL1
Oxalic Acid SCHEMBL6835798 0.88 KDM4E (0.44) KDM4EMAPTALDH1A1KMT2AL3MBTL1
SCHEMBL6835939 0.85 ALDH1A1 (0.56) KDM4EMAPTALDH1A1KMT2AL3MBTL1
SCHEMBL6835941 0.85 ALDH1A1 (0.56) KDM4EMAPTALDH1A1KMT2AL3MBTL1
Oxalic Acid SCHEMBL6839793 0.84 KMT2A (0.46) KDM4EMAPTALDH1A1KMT2AL3MBTL1
Oxalic Acid SCHEMBL6839789 0.84 KMT2A (0.46) KDM4EMAPTALDH1A1KMT2AL3MBTL1
Oxalic Acid SCHEMBL6835875 0.83 KMT2A (0.50) KDM4EMAPTALDH1A1KMT2AL3MBTL1
Oxalic Acid SCHEMBL6835874 0.83 KMT2A (0.50) KDM4EMAPTALDH1A1KMT2AL3MBTL1
Oxalic Acid SCHEMBL6838532 0.81 NPC1 (0.57) KDM4EMAPTALDH1A1KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20030013886-A1 Benzimidazole cyclooxygenase-2 inhibitors PTGS1, CBR1, CBR3 PSD 4692/4885KDM4E 1257/4885MAPT 4772/4885

“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.