⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23033478 | 1.00 | — | — | |
| SCHEMBL27694210 | 1.00 | — | — | |
| SCHEMBL15542817 | 0.73 | — | — | |
| SCHEMBL23442769 | 0.72 | — | — | |
| SCHEMBL24269404 | 0.72 | — | — | |
| SCHEMBL578444 | 0.71 | — | — | |
| SCHEMBL617847 | 0.71 | — | — | |
| SCHEMBL386370 | 0.71 | — | — | |
| SCHEMBL386418 | 0.71 | — | — | |
| SCHEMBL13586810 | 0.71 | — | — |
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-3031807-A1 | PRODRUG FORMS OF KINASE INHIBITORS AND THEIR USE IN THERAPY | Auckland UniServices Limited (NZ) | 2016-06-15 | — | — | EP | disclosed |