⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28821698 | 0.88 | — | — | |
| SCHEMBL28213610 | 0.81 | — | — | |
| SCHEMBL29254272 | 0.76 | — | — | |
| SCHEMBL28213165 | 0.75 | — | — | |
| SCHEMBL28213185 | 0.75 | — | — | |
| SCHEMBL11100378 | 0.72 | — | — | |
| SCHEMBL28026630 | 0.72 | LMNA (0.32) | — | |
| SCHEMBL28026154 | 0.71 | PPM1B (0.31) | — | |
| SCHEMBL5273481 | 0.71 | — | — | |
| SCHEMBL30708138 | 0.70 | — | — |
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-104829757-B | A kind of ingredient of solid catalyst of olefin polymerization acid esters compound containing bigcatkin willow and its preparation method and application | 中国科学院化学研究所 | 2018-04-27 | — | — | CN | disclosed |