⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8921614 | 0.98 | — | — | |
| SCHEMBL22017 | 0.98 | — | — | |
| SCHEMBL4823985 | 0.98 | — | — | |
| SCHEMBL6269152 | 0.98 | — | — | |
| SCHEMBL1057516 | 0.98 | TSHR (0.50) | — | |
| SCHEMBL28226548 | 0.98 | TSHR (0.50) | — | |
| Phosphine SCHEMBL6536445 | 0.95 | TSHR (0.48) | — | |
| Water SCHEMBL1080260 | 0.95 | TSHR (0.48) | — | |
| Charcoal, Activated SCHEMBL4931378 | 0.95 | TSHR (0.48) | — | |
| Acetone SCHEMBL11804126 | 0.95 | TSHR (0.48) | — |
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-1879065-A | Magnetically targetable particles comprising magnetic components and biocompatible polymers for site-specific delivery of biologically active agents | BANKRUPTCY ESTATE OF FERX INC (US) | 2006-12-13 | — | — | CN | disclosed |