⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17581075 | 0.70 | — | — | |
| SCHEMBL7695840 | 0.70 | — | — | |
| SCHEMBL131290 | 0.70 | — | — | |
| SCHEMBL1193325 | 0.70 | — | — | |
| SCHEMBL40167 | 0.67 | — | — | |
| Ethane SCHEMBL11004873 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL217830 | 0.67 | — | — | |
| SCHEMBL11348959 | 0.67 | — | — | |
| SCHEMBL28261179 | 0.67 | — | — | |
| Methyl Alcohol SCHEMBL4870551 | 0.65 | — | — |
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-108699032-A | Polycyclic T L R7/8 antagonists and their use in treating immune disorders | 默克专利有限公司 | 2018-10-23 | — | — | CN | disclosed |