⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28453754 | 0.83 | — | — | |
| SCHEMBL28099302 | 0.83 | — | — | |
| SCHEMBL27490165 | 0.82 | — | — | |
| SCHEMBL28158125 | 0.82 | — | — | |
| SCHEMBL28243097 | 0.82 | — | — | |
| SCHEMBL8588815 | 0.82 | — | — | |
| SCHEMBL9469869 | 0.82 | — | — | |
| SCHEMBL8015792 | 0.82 | — | — | |
| SCHEMBL29111083 | 0.82 | — | — | |
| SCHEMBL9249770 | 0.78 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102935352-B | Method for absorbing and removing heavy metal and hexavalent chromium from waste liquid by using mangosteen slag | UNIV BEIJING SCIENCE & TECH | 2015-05-13 | — | — | CN | disclosed |
| CN-102935352-A | Method for absorbing and removing heavy metal and hexavalent chromium from waste liquid by using mangosteen slag | UNIV BEIJING SCIENCE & TECH | 2013-02-20 | — | — | CN | disclosed |
| US-4343706-A | Method of removing heavy metals from industrial waste streams | PURDUE RESEARCH FOUNDATION (US) | 1982-08-10 | — | — | US | disclosed |