⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27729134 | 0.95 | — | — | |
| Water SCHEMBL2245666 | 0.94 | — | — | |
| Water SCHEMBL6512781 | 0.94 | — | — | |
| Water SCHEMBL11873407 | 0.94 | — | — | |
| Water SCHEMBL9293512 | 0.94 | — | — | |
| Water SCHEMBL718583 | 0.89 | — | — | |
| SCHEMBL8959208 | 0.89 | — | — | |
| Water SCHEMBL717161 | 0.89 | — | — | |
| SCHEMBL11674568 | 0.89 | — | — | |
| Water SCHEMBL1014182 | 0.89 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9586191-B2 | Magnetic core coated inorganic ion adsorbent for removing Cs ions in radioactive wastewater and preparation method thereof | TSINGHUA UNIVERSITY (CN) | 2017-03-07 | — | — | US | disclosed |
| US-20150231598-A1 | MAGNETIC CORE COATED INORGANIC ION ADSORBENT FOR REMOVING Cs IONS IN RADIOACTIVE WASTEWATER AND PREPARATION METHOD THEREOF | TSINGHUA UNIVERSITY (CN) | 2015-08-20 | — | — | US | disclosed |