⚠ 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 | |
|---|---|---|---|---|
| Fluorobenzene SCHEMBL15544432 | 0.89 | NFE2L2 (0.53) | — | |
| Fluorobenzene SCHEMBL7024891 | 0.89 | — | — | |
| Fluorobenzene SCHEMBL12363 | 0.89 | — | — | |
| Fluorobenzene SCHEMBL27957654 | 0.89 | NFE2L2 (0.53) | — | |
| Fluorobenzene SCHEMBL14012524 | 0.89 | — | — | |
| SCHEMBL22526495 | 0.89 | NFE2L2 (0.53) | — | |
| Fluorobenzene SCHEMBL8174371 | 0.85 | — | — | |
| Fluorobenzene SCHEMBL15754920 | 0.85 | — | — | |
| Fluorobenzene SCHEMBL21829121 | 0.85 | — | — | |
| Fluorobenzene SCHEMBL12469089 | 0.85 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107501314-B | The method of bipyridyliums Mn catalyst catalysis oxidation silane synthesis silanol | 陕西师范大学 | 2019-08-20 | — | — | CN | disclosed |
| CN-107501314-A | The method that bipyridyliumses Mn catalyst catalysis oxidation silane synthesizes silanol | 陕西师范大学 | 2017-12-22 | — | — | CN | disclosed |