⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27403674 | 0.96 | — | — | |
| SCHEMBL23177 | 0.83 | — | — | |
| Fluoromethane SCHEMBL28067679 | 0.80 | — | — | |
| Hydrogen Sulfide SCHEMBL28126271 | 0.79 | — | — | |
| Ethylene SCHEMBL27543309 | 0.79 | — | — | |
| SCHEMBL28326112 | 0.79 | — | — | |
| SCHEMBL27283514 | 0.79 | — | — | |
| SCHEMBL27276494 | 0.79 | — | — | |
| SCHEMBL28794145 | 0.79 | — | — | |
| SCHEMBL28188841 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108366994-A | Novel selective inhibitors of Jak1 and uses thereof | 梁从新 | 2018-08-03 | — | — | CN | claimed |
| CN-108366994-A | Novel selective inhibitors of Jak1 and uses thereof | 梁从新 | 2018-08-03 | — | — | CN | disclosed |
| CN-102639494-A | Sulphone compounds and methods of making and using same | ZAFGEN CORP | 2012-08-15 | — | — | CN | disclosed |
| CN-86102431-A | The guanidine class of preparation resemble the McN 3935 and the technological process of intermediates | — | 1987-07-01 | — | — | CN | disclosed |