⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25425333 | 0.74 | — | — | |
| SCHEMBL4569252 | 0.69 | — | — | |
| SCHEMBL28738451 | 0.69 | — | — | |
| SCHEMBL28119157 | 0.69 | — | — | |
| SCHEMBL8068584 | 0.65 | TSHR (0.30) | — | |
| SCHEMBL3165908 | 0.64 | ALDH1A1 (0.33) | — | |
| SCHEMBL5242031 | 0.64 | — | — | |
| SCHEMBL14349891 | 0.64 | — | — | |
| SCHEMBL20677238 | 0.64 | — | — | |
| SCHEMBL1338203 | 0.64 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106414462-A | Diaminosilane compounds | 道康宁公司 | 2017-02-15 | — | — | CN | claimed |
| CN-106459098-A | Monoaminosilane compounds | 道康宁公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-106414462-A | Diaminosilane compounds | 道康宁公司 | 2017-02-15 | — | — | CN | disclosed |