⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7796989 | 0.78 | — | — | |
| SCHEMBL7796924 | 0.77 | — | — | |
| SCHEMBL7797106 | 0.75 | — | — | |
| SCHEMBL14985186 | 0.75 | PDE4D (0.31) | — | |
| SCHEMBL7788347 | 0.75 | — | — | |
| SCHEMBL4436037 | 0.71 | — | — | |
| SCHEMBL5485606 | 0.70 | — | — | |
| SCHEMBL28192551 | 0.69 | — | — | |
| SCHEMBL24025862 | 0.68 | PDE4D (0.31) | — | |
| SCHEMBL14535150 | 0.68 | — | — |
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-0794194-B1 | A process for the preparation of 2'-deoxy-2'-halocoformycins or stereoisomers thereof | ZAIDAN HOJIN BISEIBUTSU (JP) | 2001-12-12 | — | — | EP | disclosed |
| US-5831072-A | Process for the preparation of 2'-deoxy-2'-halocoformycins or steroisomers thereof | ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) | 1998-11-03 | — | — | US | disclosed |