Known targets — ChEMBL curated mechanism
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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL7266475 | 0.82 | KCNH2 (0.47) | — | |
| Oxalic Acid SCHEMBL7267017 | 0.82 | KCNH2 (0.47) | — | |
| Oxalic Acid SCHEMBL7273896 | 0.82 | SMO (0.45) | — | |
| Oxalic Acid SCHEMBL7273815 | 0.82 | HSD11B1 (0.49) | — | |
| Oxalic Acid SCHEMBL7267807 | 0.79 | HTR3E (0.46) | — | |
| Oxalic Acid SCHEMBL7274616 | 0.77 | — | — | |
| SCHEMBL7268770 | 0.76 | DRD2 (0.49) | — | |
| SCHEMBL7275678 | 0.75 | KCNH2 (0.52) | — | |
| SCHEMBL7266942 | 0.75 | KCNH2 (0.52) | — | |
| SCHEMBL7266514 | 0.75 | HTR2A (0.45) | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4952587-A | PSYCHOLOGICAL DISORDERS, MIGRAINES, ALZHEIMER*S | MERCK SHARP & DOHME LTD. (GB) | 1990-08-28 | — | — | US | disclosed |
| EP-0328200-A1 | Five-membered ring systems with bonded azacyclic ring substituents | MERCK SHARP & DOHME LTD. (GB) | 1989-08-16 | — | — | EP | disclosed |