⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24254751 | 0.90 | — | — | |
| SCHEMBL24254766 | 0.81 | MGLL (0.38) | — | |
| SCHEMBL25639243 | 0.75 | GRIN2B (0.32) | — | |
| SCHEMBL4298574 | 0.67 | MGLL (0.50) | — | |
| SCHEMBL24254860 | 0.66 | GLA (0.37) | — | |
| SCHEMBL24254747 | 0.65 | — | — | |
| SCHEMBL12937145 | 0.65 | ESR1 (0.43) | — | |
| SCHEMBL27256051 | 0.64 | KIF11 (0.53) | — | |
| SCHEMBL25639155 | 0.64 | GRIN2B (0.32) | — | |
| SCHEMBL12937111 | 0.63 | L3MBTL1 (0.40) | — |
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-4198163-A1 | METAL PATTERNING MATERIAL, AMINE COMPOUND, ELECTRONIC DEVICE, AND METHOD FOR FORMING METAL PATTERN | Tosoh Corporation (JP) | 2023-06-21 | — | — | EP | disclosed |