⚠ 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 | |
|---|---|---|---|---|
| Krypton SCHEMBL1502314 | 0.87 | — | — | |
| Krypton SCHEMBL9298433 | 0.82 | — | — | |
| Krypton SCHEMBL27739858 | 0.75 | — | — | |
| Krypton SCHEMBL6692675 | 0.75 | — | — | |
| Krypton SCHEMBL528094 | 0.71 | — | — | |
| SCHEMBL11091332 | 0.71 | — | — | |
| SCHEMBL11293436 | 0.71 | — | — | |
| SCHEMBL5888879 | 0.71 | — | — | |
| SCHEMBL9466277 | 0.71 | — | — | |
| SCHEMBL2514121 | 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 |
|---|---|---|---|---|---|---|---|
| WO-2024019637-A1 | MEDICINAL AGENT (EMBODIMENTS) AND DEVICE FOR USING SAME | ПЕТРОВ, Василий Александрович | 2024-01-25 | — | — | WO | disclosed |