⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27849195 | 0.82 | — | — | |
| SCHEMBL1553684 | 0.80 | — | — | |
| SCHEMBL29445564 | 0.80 | — | — | |
| SCHEMBL29459645 | 0.80 | — | — | |
| SCHEMBL824165 | 0.80 | — | — | |
| SCHEMBL83934 | 0.72 | — | — | |
| SCHEMBL30378348 | 0.72 | POLB (0.32) | — | |
| SCHEMBL29000444 | 0.72 | POLB (0.32) | — | |
| SCHEMBL16007487 | 0.70 | — | — | |
| SCHEMBL6122121 | 0.68 | PDE4A (0.30) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2678333-B1 | AN IMPROVED PROCESS FOR THE PREPARATION OF VORICONAZOLE AND INTERMEDIATES THEREOF | RANBAXY LAB LTD (IN) | 2015-04-08 | — | — | EP | disclosed |