⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3598860 | 0.79 | — | — | |
| SCHEMBL11364735 | 0.77 | — | — | |
| SCHEMBL929876 | 0.77 | — | — | |
| SCHEMBL3809920 | 0.74 | — | — | |
| SCHEMBL1205559 | 0.74 | — | — | |
| SCHEMBL7159575 | 0.73 | — | — | |
| SCHEMBL28759050 | 0.73 | — | — | |
| SCHEMBL28137853 | 0.73 | — | — | |
| SCHEMBL28247080 | 0.73 | — | — | |
| SCHEMBL7228993 | 0.72 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114616226-A | Pyridine derivatives as TMEM16A modulators for the treatment of respiratory disorders | TMEM16A有限公司 | 2022-06-10 | — | — | CN | disclosed |
| CN-106061966-B | Bicyclic heterocycle derivatives as bromodomain inhibitor | 奥赖恩公司 | 2018-12-07 | — | — | CN | disclosed |
| CN-104540823-B | Alpha-carbolines for the treatment of cancer | 米兰-比科卡大学 | 2017-02-22 | — | — | CN | disclosed |