⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19446709 | 0.88 | — | — | |
| SCHEMBL1275536 | 0.72 | — | — | |
| SCHEMBL19446713 | 0.68 | — | — | |
| SCHEMBL13312973 | 0.68 | — | — | |
| SCHEMBL6841223 | 0.68 | — | — | |
| SCHEMBL13636435 | 0.64 | — | — | |
| SCHEMBL1402882 | 0.64 | CRBN (0.33) | — | |
| SCHEMBL2769601 | 0.63 | — | — | |
| SCHEMBL12090408 | 0.63 | — | — | |
| SCHEMBL2770350 | 0.63 | — | — |
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-3228652-A1 | NOVEL EPISULFIDE COMPOUND AND OPTICAL MATERIAL COMPOSITION INCLUDING SAME | Mitsubishi Gas Chemical Company, Inc. (JP) | 2017-10-11 | — | — | EP | disclosed |