⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27625358 | 0.62 | — | — | |
| SCHEMBL5779355 | 0.61 | — | — | |
| SCHEMBL910902 | 0.56 | — | — | |
| SCHEMBL23392479 | 0.56 | — | — | |
| SCHEMBL4710658 | 0.51 | — | — | |
| SCHEMBL19199488 | 0.50 | — | — | |
| SCHEMBL1934967 | 0.50 | — | — | |
| SCHEMBL24259872 | 0.50 | — | — | |
| SCHEMBL21407269 | 0.49 | — | — | |
| SCHEMBL878822 | 0.49 | — | — |
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-3784666-A1 | ANTIPROLIFERATION COMPOUNDS AND USES THEREOF | Merck Patent GmbH (DE) | 2021-03-03 | — | — | EP | disclosed |