⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28099289 | 0.93 | — | — | |
| SCHEMBL28097788 | 0.91 | — | — | |
| SCHEMBL27623379 | 0.91 | — | — | |
| SCHEMBL27647188 | 0.91 | — | — | |
| SCHEMBL31403459 | 0.91 | — | — | |
| SCHEMBL28201906 | 0.83 | — | — | |
| SCHEMBL28099302 | 0.83 | — | — | |
| SCHEMBL31403460 | 0.83 | — | — | |
| SCHEMBL11230852 | 0.83 | — | — | |
| SCHEMBL28013978 | 0.83 | — | — |
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-111220596-A | ICP (inductively coupled plasma) determination method for heavy metals cadmium, lead, chromium, zinc, copper and nickel in organic fertilizer | 内蒙古路易精普检测科技有限公司 | 2020-06-02 | — | — | CN | claimed |