⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20235881 | 0.83 | — | — | |
| SCHEMBL329361 | 0.71 | — | — | |
| SCHEMBL1085520 | 0.69 | — | — | |
| SCHEMBL29280955 | 0.67 | — | — | |
| SCHEMBL28308447 | 0.67 | — | — | |
| SCHEMBL6845315 | 0.67 | — | — | |
| SCHEMBL20235889 | 0.67 | — | — | |
| SCHEMBL15766938 | 0.65 | — | — | |
| SCHEMBL3148184 | 0.62 | — | — | |
| SCHEMBL25309528 | 0.62 | — | — |
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-104926848-B | A kind of method preparing methyl-boric acid | 沧州普瑞东方科技有限公司 | 2016-09-28 | — | — | CN | disclosed |