⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9763853 | 1.00 | — | — | |
| SCHEMBL9250461 | 0.76 | CHRM1 (0.36) | — | |
| SCHEMBL9763824 | 0.76 | THRB (0.35) | — | |
| SCHEMBL444373 | 0.69 | — | — | |
| SCHEMBL10918472 | 0.69 | — | — | |
| SCHEMBL2328444 | 0.69 | — | — | |
| SCHEMBL132643 | 0.69 | — | — | |
| SCHEMBL1404687 | 0.67 | — | — | |
| SCHEMBL1404740 | 0.67 | — | — | |
| SCHEMBL8846632 | 0.67 | — | — |
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-5036071-A | Herper virus | MEDIVIR AB (SE) | 1991-07-30 | — | — | US | disclosed |
| EP-0186640-B1 | DERIVATIVES OF PURINE, PROCESS FOR THEIR PREPARATION AND A PHARMACEUTICAL PREPARATION | Medivir Aktiebolag (SE) | 1990-02-07 | — | — | EP | disclosed |
| EP-0186640-A1 | Derivatives of purine, process for their preparation and a pharmaceutical preparation | Medivir Aktiebolag (SE) | 1986-07-02 | — | — | EP | disclosed |