⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL811820 | 0.77 | — | — | |
| SCHEMBL10092107 | 0.71 | — | — | |
| SCHEMBL811927 | 0.71 | — | — | |
| SCHEMBL4754426 | 0.67 | — | — | |
| SCHEMBL19000390 | 0.67 | — | — | |
| SCHEMBL6940147 | 0.67 | — | — | |
| SCHEMBL4636540 | 0.67 | NOS3 (0.31) | — | |
| SCHEMBL2059894 | 0.66 | — | — | |
| SCHEMBL10039168 | 0.65 | KMT2A (0.30) | — | |
| SCHEMBL14432297 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1879543-B1 | DENTAL COMPOSITIONS CONTAINING HYBRID MONOMERS | 3M INNOVATIVE PROPERTIES CO (US) | 2012-11-21 | — | — | EP | disclosed |
| US-20080194722-A1 | Dental Compositions Containing Hybrid Monomers | 3M INNOVATIVE PROPERTIES COMPANY | 2008-08-14 | — | — | US | disclosed |
| EP-1879543-A1 | DENTAL COMPOSITIONS CONTAINING HYBRID MONOMERS | 3M Innovative Properties Company (US) | 2008-01-23 | — | — | EP | disclosed |
| WO-2006122081-A1 | DENTAL COMPOSITIONS CONTAINING HYBRID MONOMERS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2006-11-16 | — | — | WO | disclosed |