⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6151310 | 0.78 | — | — | |
| SCHEMBL110593 | 0.72 | — | — | |
| SCHEMBL428851 | 0.72 | — | — | |
| SCHEMBL22534493 | 0.72 | — | — | |
| SCHEMBL1002166 | 0.72 | — | — | |
| SCHEMBL28434804 | 0.71 | — | — | |
| SCHEMBL3947050 | 0.70 | — | — | |
| SCHEMBL3865073 | 0.68 | — | — | |
| SCHEMBL7948940 | 0.68 | — | — | |
| SCHEMBL1069448 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114874256-B | Organosilicon quaternary ammonium salt biguanide salt material, preparation method and antibacterial application | 北京百灵威科技有限公司 | 2024-04-05 | — | — | CN | disclosed |
| CN-114874256-A | Organosilicon quaternary ammonium salt biguanide salt material, preparation method and antibacterial application | 北京百灵威科技有限公司 | 2022-08-09 | — | — | CN | disclosed |
| US-4455415-A | POLYSILOXANES BY REACTING A PRIMARY AMINE AND HALOORGANOTRIALKOXYSILANE, BASIFYING AND POLYMERIZING WITH WATER | DEGUSSA AKTIENGESELLSCHAFT (DE) | 1984-06-19 | — | — | US | disclosed |