⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL910399 | 0.78 | — | — | |
| SCHEMBL14548254 | 0.76 | — | — | |
| SCHEMBL16264286 | 0.76 | — | — | |
| SCHEMBL14574522 | 0.74 | — | — | |
| SCHEMBL17929032 | 0.67 | — | — | |
| SCHEMBL17929035 | 0.67 | — | — | |
| SCHEMBL10017382 | 0.65 | — | — | |
| SCHEMBL18652005 | 0.64 | — | — | |
| SCHEMBL22428880 | 0.61 | — | — | |
| SCHEMBL19002171 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017098421-A1 | BENZOTHIADIAZINE COMPOUNDS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2017-06-15 | — | — | WO | disclosed |