⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16425954 | 1.00 | — | — | |
| SCHEMBL18073620 | 1.00 | — | — | |
| SCHEMBL20345789 | 0.95 | — | — | |
| SCHEMBL12725247 | 0.89 | — | — | |
| SCHEMBL20345782 | 0.89 | — | — | |
| SCHEMBL13133223 | 0.84 | — | — | |
| SCHEMBL13923825 | 0.81 | — | — | |
| SCHEMBL41538 | 0.81 | — | — | |
| SCHEMBL15856228 | 0.79 | — | — | |
| SCHEMBL3474970 | 0.78 | — | — |
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-9588257-B2 | Photochromic curable composition | TOKUYAMA CORPORATION (JP) | 2017-03-07 | — | — | US | disclosed |
| US-20140146285-A1 | PHOTOCHROMIC CURABLE COMPOSITION | TOKUYAMA CORPORATION (JP) | 2014-05-29 | — | — | US | disclosed |