⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7978095 | 0.82 | — | — | |
| SCHEMBL4941359 | 0.82 | — | — | |
| SCHEMBL9412076 | 0.79 | — | — | |
| SCHEMBL11305333 | 0.79 | — | — | |
| SCHEMBL11782419 | 0.74 | — | — | |
| SCHEMBL10865887 | 0.72 | — | — | |
| SCHEMBL4693644 | 0.71 | — | — | |
| SCHEMBL9385886 | 0.71 | — | — | |
| SCHEMBL10580762 | 0.70 | — | — | |
| SCHEMBL4542505 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010116173-A1 | DEPSIPEPTIDES AND THEIR THERAPEUTIC USE | KARUS THERAPEUTICS LIMITED (GB) | 2010-10-14 | — | — | WO | disclosed |
| EP-0627434-A1 | Tricyclic quinoxalinedione derivatives | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 1994-12-07 | — | — | EP | disclosed |