⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25813 | 0.83 | — | — | |
| SCHEMBL19676584 | 0.73 | CA1 (0.30) | — | |
| SCHEMBL6463785 | 0.71 | CA1 (0.31) | — | |
| SCHEMBL28050195 | 0.69 | — | — | |
| SCHEMBL17042286 | 0.67 | — | — | |
| SCHEMBL1325226 | 0.66 | AR (0.30) | — | |
| SCHEMBL15791664 | 0.64 | — | — | |
| SCHEMBL27681377 | 0.64 | CUL4A (0.33) | — | |
| SCHEMBL28879083 | 0.64 | CA3 (0.38) | — | |
| SCHEMBL22926401 | 0.64 | AR (0.44) | — |
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-1067405-A1 | Optical waveguides derived from a combination of poly(perfluorocyclobutanes) and polymeric cyanates | Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) | 2001-01-10 | — | — | EP | disclosed |
| EP-1067149-A1 | Polycyanate copolymers prepared from polyfunctional cyanates and fluorinated monocyanates | Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) | 2001-01-10 | — | — | EP | disclosed |