⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL273897 | 0.93 | — | — | |
| SCHEMBL28194690 | 0.90 | — | — | |
| Bromide SCHEMBL15006549 | 0.90 | — | — | |
| Iodide SCHEMBL15006613 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL1338990 | 0.90 | — | — | |
| SCHEMBL2055336 | 0.81 | — | — | |
| Oxalic Acid SCHEMBL29212837 | 0.77 | GABRP (0.37) | — | |
| Acetic Acid SCHEMBL29212835 | 0.75 | GABRP (0.35) | — | |
| SCHEMBL300703 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL15017471 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0418143-B1 | Dicarboxylic acids derivatives containing a nitrogen or oxygen heteroring, process for their preparation and their use as medicines | ROUSSEL UCLAF (FR) | 1994-03-23 | — | — | EP | claimed |
| EP-0418143-A1 | Dicarboxylic acids derivatives containing a nitrogen or oxygen heteroring, process for their preparation and their use as medicines | ROUSSEL-UCLAF (FR) | 1991-03-20 | — | — | EP | claimed |