⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL129388 | 0.63 | — | — | |
| SCHEMBL246981 | 0.63 | — | — | |
| SCHEMBL6952089 | 0.55 | — | — | |
| Charcoal, Activated SCHEMBL8196903 | 0.45 | — | — | |
| SCHEMBL6533032 | 0.45 | — | — | |
| SCHEMBL30149421 | 0.45 | — | — | |
| SCHEMBL28414225 | 0.45 | — | — | |
| Fluoride Ion SCHEMBL4948383 | 0.32 | — | — | |
| Fluoride Ion SCHEMBL1052081 | 0.32 | — | — | |
| SCHEMBL11764334 | 0.32 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6022945-A | CATALYST IS COMPOSED OF A PHOSPHAZENE COMPOUND OR A PHOSPHAZENIUM SALT | MITSUI CHEMICALS, INC. (JP) | 2000-02-08 | — | — | US | disclosed |
| US-5952457-A | CATALYST COMPOSED OF PHOSPHAZENE COMPOUND OR PHOSPHAZENIUM SALT WHICH IS DERIVED FROM THE PHOSPHAZENE COMPOUND AND AN ACTIVE HYDROGEN COMPOUND | MITSUI CHEMICALS, INC. (JP) | 1999-09-14 | — | — | US | disclosed |
| EP-0763555-A2 | Alkylene oxide polymerisation catalysts | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1997-03-19 | — | — | EP | disclosed |