⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9761860 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL9761812 | 0.79 | — | — | |
| SCHEMBL27280935 | 0.73 | — | — | |
| SCHEMBL27287329 | 0.73 | ADRB2 (0.41) | — | |
| SCHEMBL9762703 | 0.73 | — | — | |
| SCHEMBL27280591 | 0.73 | ADRB2 (0.41) | — | |
| SCHEMBL27280933 | 0.73 | ADRB2 (0.41) | — | |
| SCHEMBL196713 | 0.71 | — | — | |
| SCHEMBL12179509 | 0.70 | — | — | |
| SCHEMBL394265 | 0.67 | — | — |
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-3844144-A1 | NEW FUNCTIONALISED TETRAZENE COMPOUNDS | ArianeGroup SAS (FR) | 2021-07-07 | — | — | EP | claimed |
| WO-2020043997-A1 | NEW FUNCTIONALISED TETRAZENE COMPOUNDS | ARIANEGROUP SAS (FR) | 2020-03-05 | — | — | WO | claimed |