⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2269510 | 0.72 | — | — | |
| SCHEMBL890319 | 0.67 | — | — | |
| Hexane SCHEMBL28273202 | 0.65 | TSHR (0.48) | — | |
| SCHEMBL28618959 | 0.65 | — | — | |
| SCHEMBL2100224 | 0.65 | TSHR (0.40) | — | |
| SCHEMBL9052180 | 0.64 | — | — | |
| SCHEMBL2272599 | 0.64 | — | — | |
| SCHEMBL8769646 | 0.64 | — | — | |
| SCHEMBL31236 | 0.64 | — | — | |
| SCHEMBL3259481 | 0.63 | — | — |
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-108017663-B | Method for producing silane compound containing bis (silyl) amino group | 信越化学工业株式会社 | 2022-05-13 | — | — | CN | disclosed |