⚠ 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 | |
|---|---|---|---|---|
| Methylene Chloride SCHEMBL28167708 | 0.93 | — | — | |
| Methylene Chloride SCHEMBL318992 | 0.91 | — | — | |
| Methylene Chloride SCHEMBL28218034 | 0.91 | — | — | |
| Methylene Chloride SCHEMBL28649479 | 0.87 | — | — | |
| Methylene Chloride SCHEMBL4715392 | 0.83 | — | — | |
| Methylene Chloride SCHEMBL28542553 | 0.83 | — | — | |
| Methylene Chloride SCHEMBL28232334 | 0.83 | — | — | |
| Methylene Chloride SCHEMBL8546647 | 0.82 | — | — | |
| Methylene Chloride SCHEMBL493 | 0.82 | — | — | |
| Methylene Chloride SCHEMBL18247337 | 0.82 | — | — |
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-105102453-B | benzimidazolone derivatives as bromodomain inhibitors | 吉利德科学公司 | 2018-04-06 | — | — | CN | disclosed |