⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7667367 | 0.85 | — | — | |
| SCHEMBL5829649 | 0.83 | CA12 (0.32) | — | |
| SCHEMBL5830063 | 0.78 | CA12 (0.32) | — | |
| SCHEMBL7972443 | 0.75 | — | — | |
| SCHEMBL11099154 | 0.74 | — | — | |
| SCHEMBL11710345 | 0.72 | LMNA (0.42) | — | |
| SCHEMBL7748965 | 0.70 | — | — | |
| SCHEMBL5417885 | 0.70 | — | — | |
| SCHEMBL9332326 | 0.70 | — | — | |
| SCHEMBL6155203 | 0.70 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101341191-B | Silicon-containing monomers end-capped with polymerizable cationic hydrophilic groups | BAUSCH & LOMB | 2013-11-06 | — | — | CN | disclosed |
| CN-101341191-A | Silicon-containing monomers end-capped with polymerizable cationic hydrophilic groups | BAUSCH & LOMB (US) | 2009-01-07 | — | — | CN | disclosed |
| EP-1963403-A2 | SILICON-CONTAINING MONOMERS END-CAPPED WITH POLYMERIZABLE CATIONIC HYDROPHILIC GROUPS | BAUSCH & LOMB INCORPORATED (US) | 2008-09-03 | — | — | EP | disclosed |
| WO-2007078661-A2 | SILICON-CONTAINING MONOMERS END-CAPPED WITH POLYMERIZABLE CATIONIC HYDROPHILIC GROUPS | BAUSCH & LOMB INCORPORATED (US) | 2007-07-12 | — | — | WO | disclosed |