⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL436472 | 0.81 | — | — | |
| SCHEMBL436474 | 0.81 | — | — | |
| SCHEMBL435235 | 0.78 | — | — | |
| SCHEMBL435233 | 0.78 | — | — | |
| SCHEMBL1564311 | 0.76 | — | — | |
| SCHEMBL7791698 | 0.75 | — | — | |
| SCHEMBL7795809 | 0.73 | — | — | |
| SCHEMBL436311 | 0.72 | — | — | |
| SCHEMBL27450740 | 0.71 | LMNA (0.32) | — | |
| SCHEMBL7791530 | 0.71 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20010056197-A1 | Ormocers, method for their production, and their use | DEGUSSA DENTAL GMBH & CO. KG (DE) | 2001-12-27 | — | — | US | disclosed |
| US-20010051672-A1 | Dental material based on cationically polymerizable monomers | DEGUSSA DENTAL GMBH & CO. KG (DE) | 2001-12-13 | — | — | US | disclosed |