Oxalic Acid

Oxalic Acid

SCHEMBL7400341

CCCN1CC=CC(CC/C(=N/O)c2ccccc2)C1.O=C(O)C(=O)O

nearest known ligand 0.36

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
DRD4 P21917 3/20 0.36
KDM2B Q8NHM5 6/20 0.35
DRD3 P35462 2/20 0.34
HRH3 Q9Y5N1 1/20 0.34
DRD2 P14416 1/20 0.33
DRD1 P21728 1/20 0.33
DRD5 P21918 1/20 0.33
KCNH2 Q12809 1/20 0.32

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 SCHEMBL7400346 1.00 DRD4 (0.36) DRD4KDM2BDRD3HRH3DRD2
Oxalic Acid SCHEMBL7401971 0.89 KDM2B (0.44) KDM2BDRD2
Oxalic Acid SCHEMBL7401973 0.89 KDM2B (0.44) KDM2BDRD2
Oxalic Acid SCHEMBL7402350 0.88 KDM4E (0.39) KDM2B
Oxalic Acid SCHEMBL467153 0.69 DRD4 (0.40) DRD4HRH3
Oxalic Acid SCHEMBL467154 0.69 DRD4 (0.40) DRD4HRH3
Oxalic Acid SCHEMBL7367006 0.68 SMN1; SMN2 (0.32) DRD4
SCHEMBL5449384 0.65 ATM (0.54) DRD4
SCHEMBL14604957 0.65 ATM (0.54) DRD4
SCHEMBL5449388 0.65 ATM (0.54) DRD4

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
WO-1993019047-A1 TETRAHIDROPYRIDINYL (3/4) SUBSTITUED OXIMES HAVING SIGMA RECEPTOR AFFINITY AND THEIR USE IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM CONDITIONS WARNER-LAMBERT COMPANY (US) 1993-09-30 WO disclosed
US-5208343-A Antidepressants, antiinflammatory WARNER-LAMBERT COMPANY (US) 1993-05-04 US disclosed