⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24503825 | 0.75 | — | — | |
| SCHEMBL14622069 | 0.72 | — | — | |
| SCHEMBL19625172 | 0.70 | — | — | |
| SCHEMBL27278045 | 0.69 | — | — | |
| SCHEMBL14598360 | 0.69 | — | — | |
| SCHEMBL25882969 | 0.69 | — | — | |
| SCHEMBL15384230 | 0.69 | — | — | |
| SCHEMBL25810322 | 0.67 | — | — | |
| SCHEMBL13906604 | 0.65 | — | — | |
| SCHEMBL27377802 | 0.65 | — | — |
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-1806585-A1 | Detection, monitoring and treatment of cancer | THE OPEN UNIVERSITY (GB) | 2007-07-11 | — | — | EP | disclosed |