⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21662214 | 0.90 | — | — | |
| SCHEMBL19185604 | 0.73 | — | — | |
| SCHEMBL10614405 | 0.69 | — | — | |
| SCHEMBL7189612 | 0.65 | CA1 (0.33) | — | |
| SCHEMBL7186359 | 0.65 | MEN1 (0.33) | — | |
| SCHEMBL1446287 | 0.65 | MEN1 (0.33) | — | |
| SCHEMBL5250486 | 0.60 | — | — | |
| SCHEMBL28942555 | 0.60 | — | — | |
| SCHEMBL21183185 | 0.60 | CA1 (0.39) | — | |
| SCHEMBL24406018 | 0.58 | CA1 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230242556-A1 | NOVEL METHOD FOR MANUFACTURING DEUTERATED BORON COMPOUND | SFC CO., LTD. (KR) | 2023-08-03 | — | — | US | disclosed |