⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23493062 | 0.87 | — | — | |
| SCHEMBL9938511 | 0.85 | — | — | |
| SCHEMBL30479410 | 0.81 | TBXAS1 (0.33) | — | |
| SCHEMBL1692131 | 0.78 | ALOX15 (0.30) | — | |
| SCHEMBL3795801 | 0.78 | TDP1 (0.31) | — | |
| SCHEMBL23493064 | 0.73 | TBXAS1 (0.36) | — | |
| SCHEMBL12870019 | 0.70 | TSHR (0.51) | — | |
| SCHEMBL403239 | 0.69 | TBXAS1 (0.34) | — | |
| SCHEMBL164095 | 0.68 | — | — | |
| SCHEMBL10901940 | 0.67 | TDP1 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2432808-A1 | ACTINICALLY-CROSSLINKABLE SILOXANE-CONTAINING COPOLYMERS | Novartis AG (CH) | 2012-03-28 | — | — | EP | claimed |
| WO-2010133680-A1 | ACTINICALLY-CROSSLINKABLE SILOXANE-CONTAINING COPOLYMERS | NOVARTIS AG (CH) | 2010-11-25 | — | — | WO | claimed |