⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2798398 | 0.81 | — | — | |
| SCHEMBL16714833 | 0.80 | — | — | |
| SCHEMBL11195464 | 0.73 | MMP1 (0.34) | — | |
| SCHEMBL8079919 | 0.70 | — | — | |
| SCHEMBL4640836 | 0.70 | — | — | |
| SCHEMBL16714777 | 0.70 | — | — | |
| SCHEMBL5581500 | 0.70 | LMNA (0.31) | — | |
| SCHEMBL11876830 | 0.70 | MMP1 (0.30) | — | |
| SCHEMBL87881 | 0.68 | DNM1 (0.33) | — | |
| SCHEMBL16714739 | 0.68 | — | — |
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-114573630-A | Method for producing nitrogen-containing organooxysilane compound | 信越化学工业株式会社 | 2022-06-03 | — | — | CN | disclosed |