⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5656831 | 0.72 | — | — | |
| SCHEMBL25918801 | 0.70 | — | — | |
| SCHEMBL8133005 | 0.70 | — | — | |
| SCHEMBL11224369 | 0.69 | SLC6A3 (0.33) | — | |
| SCHEMBL14446370 | 0.69 | — | — | |
| SCHEMBL3443913 | 0.67 | SLC6A3 (0.32) | — | |
| SCHEMBL232066 | 0.66 | — | — | |
| SCHEMBL8741562 | 0.65 | SLC6A3 (0.31) | — | |
| SCHEMBL15277291 | 0.65 | SLC6A3 (0.40) | — | |
| SCHEMBL27337970 | 0.64 | EPHX1 (0.32) | — |
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-105061392-B | A kind of guanoxan sulfate synthetic method | 上海现代哈森（商丘）药业有限公司 | 2017-07-18 | — | — | CN | disclosed |