⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6033866 | 0.67 | — | — | |
| SCHEMBL5488803 | 0.63 | — | — | |
| SCHEMBL14473180 | 0.52 | — | — | |
| SCHEMBL9625913 | 0.51 | — | — | |
| SCHEMBL4080848 | 0.47 | — | — | |
| SCHEMBL7851839 | 0.47 | — | — | |
| SCHEMBL1083341 | 0.47 | — | — | |
| SCHEMBL904190 | 0.46 | KDM4E (0.37) | — | |
| SCHEMBL1089282 | 0.45 | — | — | |
| SCHEMBL1787799 | 0.44 | PDE10A (0.39) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6894047-B2 | Triazine compounds useful as sorbitol dehydrogenase inhibitors | PFIZER INC. (US) | 2005-05-17 | — | — | US | disclosed |
| US-20030004166-A1 | Novel triazine compounds useful as sorbitol dehydrogenase inhibitors | PFIZER INC. | 2003-01-02 | — | — | US | disclosed |
| EP-1247809-A2 | Triazine compounds useful as sorbitol dehydrogenase inhibitors | Pfizer Products Inc. (US) | 2002-10-09 | — | — | EP | disclosed |