⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL62496 | 0.89 | — | — | |
| SCHEMBL2384525 | 0.89 | — | — | |
| SCHEMBL25242925 | 0.84 | — | — | |
| SCHEMBL29224070 | 0.80 | — | — | |
| SCHEMBL29144518 | 0.80 | — | — | |
| SCHEMBL28446521 | 0.80 | — | — | |
| SCHEMBL7267996 | 0.80 | — | — | |
| SCHEMBL2792515 | 0.80 | — | — | |
| SCHEMBL22117317 | 0.80 | — | — | |
| SCHEMBL25294067 | 0.80 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113000589-A | Contaminated soil remediation method | 中山大学 | 2021-06-22 | — | — | CN | claimed |
| CN-113000589-A | Contaminated soil remediation method | 中山大学 | 2021-06-22 | — | — | CN | disclosed |
| CN-111154491-B | Preparation and application of heavy metal polluted acid soil remediation-improvement material | 南京林业大学 | 2021-02-09 | — | — | CN | disclosed |
| CN-111154491-A | Preparation and application of heavy metal polluted acid soil remediation-improvement material | 南京林业大学 | 2020-05-15 | — | — | CN | disclosed |
| CN-105199736-A | Calcium-iron-silicon-based composite material for restoring heavy metal polluted acid soil and application thereof | UNIV SUN YAT SEN | 2015-12-30 | — | — | CN | disclosed |