⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8191043 | 0.97 | — | — | |
| SCHEMBL23409709 | 0.89 | CA2 (0.33) | — | |
| SCHEMBL31474332 | 0.89 | CA2 (0.33) | — | |
| SCHEMBL23409712 | 0.89 | CA2 (0.33) | — | |
| SCHEMBL1696966 | 0.89 | CA2 (0.33) | — | |
| Propene SCHEMBL14718441 | 0.85 | — | — | |
| SCHEMBL751498 | 0.80 | — | — | |
| SCHEMBL29137549 | 0.80 | — | — | |
| Tromethamine SCHEMBL4340758 | 0.79 | MEN1 (0.42) | — | |
| SCHEMBL17333164 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108200760-A | BENZODIAZEPINE DERIVATIVES AS RSV INHIBITORS | 英安塔制药有限公司 | 2018-06-22 | — | — | CN | disclosed |