⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21916836 | 1.00 | — | — | |
| SCHEMBL24946103 | 1.00 | — | — | |
| SCHEMBL17780279 | 1.00 | — | — | |
| SCHEMBL24946102 | 1.00 | — | — | |
| SCHEMBL17780230 | 0.84 | CA1 (0.40) | — | |
| SCHEMBL17780148 | 0.84 | CA1 (0.35) | — | |
| SCHEMBL11940418 | 0.84 | CA1 (0.35) | — | |
| SCHEMBL17780150 | 0.84 | CA1 (0.35) | — | |
| SCHEMBL17780145 | 0.84 | CA1 (0.40) | — | |
| SCHEMBL17780140 | 0.84 | CA1 (0.35) | — |
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-2023008470-A1 | FUSED-RING AMINE DERIVATIVE | 住友ファーマ株式会社 | 2023-02-02 | — | — | WO | disclosed |