⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16637915 | 1.00 | — | — | |
| SCHEMBL18059669 | 1.00 | — | — | |
| SCHEMBL16644682 | 1.00 | — | — | |
| SCHEMBL30082038 | 0.86 | — | — | |
| SCHEMBL30082044 | 0.86 | — | — | |
| SCHEMBL18058602 | 0.86 | — | — | |
| SCHEMBL30082050 | 0.82 | — | — | |
| SCHEMBL30668965 | 0.80 | — | — | |
| SCHEMBL30082061 | 0.80 | — | — | |
| SCHEMBL19726000 | 0.79 | — | — |
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-3055311-A1 | NITROGEN CONTAINING COMPOUNDS AND THEIR USE | Wockhardt Limited (IN) | 2016-08-17 | — | — | EP | claimed |
| WO-2015052682-A1 | NITROGEN CONTAINING COMPOUNDS AND THEIR USE | WOCKHARDT LIMITED (IN) | 2015-04-16 | — | — | WO | claimed |