⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27727353 | 1.00 | — | — | |
| SCHEMBL27350979 | 1.00 | — | — | |
| SCHEMBL160387 | 1.00 | — | — | |
| SCHEMBL296818 | 0.82 | — | — | |
| SCHEMBL159943 | 0.82 | — | — | |
| SCHEMBL5840167 | 0.82 | — | — | |
| SCHEMBL17633429 | 0.82 | — | — | |
| SCHEMBL17159990 | 0.82 | — | — | |
| SCHEMBL10417664 | 0.82 | — | — | |
| SCHEMBL8014384 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105396149-B | A kind of Nanoalloy anticancer drug and preparation method thereof with autonomous targeting and imaging function | 宋玉军 | 2018-10-09 | — | — | CN | disclosed |
| CN-103840076-B | A kind of carbon fiber/zinc oxide-zinc selenide bivalve micro-line nano generator nano material and its preparation method and application | 哈尔滨师范大学 | 2016-09-07 | — | — | CN | disclosed |