⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1424347 | 0.61 | — | — | |
| SCHEMBL4754857 | 0.59 | — | — | |
| SCHEMBL4315743 | 0.59 | — | — | |
| SCHEMBL4315746 | 0.59 | — | — | |
| SCHEMBL15542153 | 0.57 | — | — | |
| SCHEMBL5176880 | 0.57 | — | — | |
| SCHEMBL20403383 | 0.53 | — | — | |
| SCHEMBL235429 | 0.52 | — | — | |
| SCHEMBL380648 | 0.52 | — | — | |
| SCHEMBL8744019 | 0.51 | — | — |
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-3757100-B1 | TRIAZINE COMPOUNDS SUBSTITUTED WITH BULKY GROUPS | NOVALED GMBH (DE) | 2022-12-28 | — | — | EP | disclosed |