⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3483659 | 0.67 | — | — | |
| SCHEMBL5487213 | 0.65 | — | — | |
| SCHEMBL5542135 | 0.65 | — | — | |
| SCHEMBL1454694 | 0.65 | — | — | |
| SCHEMBL5542138 | 0.65 | — | — | |
| SCHEMBL82443 | 0.64 | — | — | |
| SCHEMBL135471 | 0.64 | — | — | |
| SCHEMBL1454504 | 0.62 | — | — | |
| SCHEMBL27997646 | 0.61 | — | — | |
| SCHEMBL12812965 | 0.61 | — | — |
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 |