⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2786155 | 1.00 | — | — | |
| SCHEMBL16659516 | 0.85 | — | — | |
| SCHEMBL7529686 | 0.79 | — | — | |
| SCHEMBL23505340 | 0.79 | MAPT (0.32) | — | |
| SCHEMBL15927296 | 0.79 | — | — | |
| SCHEMBL16659517 | 0.77 | — | — | |
| SCHEMBL15546449 | 0.76 | — | — | |
| SCHEMBL17348570 | 0.74 | — | — | |
| SCHEMBL1218895 | 0.74 | — | — | |
| SCHEMBL16666909 | 0.74 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4400502-A2 | TRIAZINE DERIVATIVES HAVING VIRUS REPLICATION INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | Shionogi & Co., Ltd (JP) | 2024-07-17 | — | — | EP | disclosed |