⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19840922 | 0.90 | — | — | |
| SCHEMBL25910738 | 0.72 | — | — | |
| SCHEMBL20749581 | 0.71 | — | — | |
| SCHEMBL19987579 | 0.66 | KDM1A (0.30) | — | |
| SCHEMBL21005130 | 0.66 | — | — | |
| Methylamine SCHEMBL27392081 | 0.64 | — | — | |
| Methylamine SCHEMBL148244 | 0.64 | — | — | |
| SCHEMBL22839317 | 0.63 | — | — | |
| SCHEMBL23514124 | 0.63 | ALDH1A1 (0.37) | — | |
| SCHEMBL19736417 | 0.62 | — | — |
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-2022034907-A1 | METAL PATTERNING MATERIAL, AMINE COMPOUND, ELECTRONIC DEVICE, AND METHOD FOR FORMING METAL PATTERN | 東ソー株式会社 | 2022-02-17 | — | — | WO | disclosed |