⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL400344 | 0.95 | — | — | |
| SCHEMBL12272287 | 0.95 | — | — | |
| SCHEMBL1226137 | 0.95 | — | — | |
| SCHEMBL400244 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL28783730 | 0.90 | — | — | |
| Fluoride SCHEMBL28779410 | 0.90 | — | — | |
| SCHEMBL31243568 | 0.90 | — | — | |
| Bromide SCHEMBL29217867 | 0.90 | — | — | |
| SCHEMBL27638739 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL27779801 | 0.90 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-113353939-A | Band gap adjustable and degradability controllable two-dimensional hydrosilylene nano material and preparation method and application thereof | 中国科学院上海硅酸盐研究所 | 2021-09-07 | — | — | CN | disclosed |