⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27565231 | 1.00 | — | — | |
| SCHEMBL19303377 | 1.00 | — | — | |
| SCHEMBL28023128 | 0.81 | CA1 (0.44) | — | |
| SCHEMBL5990289 | 0.78 | CA1 (0.59) | — | |
| SCHEMBL776575 | 0.78 | — | — | |
| SCHEMBL4610879 | 0.77 | — | — | |
| SCHEMBL4610884 | 0.77 | — | — | |
| SCHEMBL15421871 | 0.77 | — | — | |
| SCHEMBL15607878 | 0.75 | CA1 (0.50) | — | |
| SCHEMBL12436241 | 0.75 | KDM4E (0.39) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120302487-A1 | COMPOSITE | REVOLYMER LIMITED (GB) | 2012-11-29 | — | — | US | disclosed |
| EP-2494024-A1 | COMPOSITE | Revolymer Limited (GB) | 2012-09-05 | — | — | EP | disclosed |
| WO-2011051681-A1 | COMPOSITE | REVOLYMER LIMITED (GB) | 2011-05-05 | — | — | WO | disclosed |