⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27737320 | 0.96 | ALDH1A1 (0.50) | — | |
| SCHEMBL3025 | 0.96 | — | — | |
| SCHEMBL8749615 | 0.92 | — | — | |
| SCHEMBL26688664 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL28307052 | 0.92 | — | — | |
| Bromide SCHEMBL27709856 | 0.92 | — | — | |
| Water SCHEMBL27543345 | 0.92 | — | — | |
| Ammonia Solution, Strong SCHEMBL18490013 | 0.92 | — | — | |
| SCHEMBL28176468 | 0.92 | — | — | |
| Methyl Alcohol SCHEMBL27821610 | 0.92 | — | — |
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-105085564-B | A kind of synthetic method of pesticide Silthiopham | 杭州师范大学 | 2019-05-14 | — | — | CN | claimed |