⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1462282 | 1.00 | — | — | |
| SCHEMBL23426 | 1.00 | — | — | |
| SCHEMBL27646529 | 0.96 | — | — | |
| SCHEMBL28123945 | 0.96 | — | — | |
| SCHEMBL4619187 | 0.74 | — | — | |
| SCHEMBL107996 | 0.72 | TSHR (0.38) | — | |
| SCHEMBL107995 | 0.72 | TSHR (0.38) | — | |
| SCHEMBL83813 | 0.72 | — | — | |
| SCHEMBL231687 | 0.72 | — | — | |
| SCHEMBL27877365 | 0.72 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2070507-B1 | Hardening composition | DENTSPLY DETREY GMBH (DE) | 2013-09-04 | — | — | EP | disclosed |
| US-8440740-B2 | Dental glass compositions utilizing a glass ionomer and an acidic copolymer | DENTSPLY INTERNATIONAL INC. (US) | 2013-05-14 | — | — | US | disclosed |
| US-20110071233-A1 | HARDENING COMPOSITION | BLACKWELL GORDON | 2011-03-24 | — | — | US | disclosed |
| WO-2009077113-A2 | HARDENING COMPOSITION | DENTSPLY DETREY GMBH (DE) | 2009-06-25 | — | — | WO | disclosed |
| EP-2070507-A1 | Hardening composition | Dentsply DeTrey GmbH (DE) | 2009-06-17 | — | — | EP | disclosed |