⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10583900 | 0.91 | — | — | |
| SCHEMBL7735578 | 0.91 | — | — | |
| SCHEMBL18187078 | 0.91 | — | — | |
| SCHEMBL1168334 | 0.91 | — | — | |
| SCHEMBL3782878 | 0.91 | — | — | |
| SCHEMBL18187089 | 0.91 | — | — | |
| SCHEMBL18187185 | 0.91 | — | — | |
| SCHEMBL18188042 | 0.91 | — | — | |
| SCHEMBL18187385 | 0.91 | — | — | |
| SCHEMBL8335757 | 0.91 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0068584-B1 | BORON CONTAINING POLYPHOSPHONATES FOR THE TREATMENT OF CALCIFIC TUMORS | THE PROCTER & GAMBLE COMPANY (US) | 1985-09-25 | — | — | EP | disclosed |
| US-4399817-A | Boron containing polyphosphonates for the treatment of calcific tumors | THE PROCTER & GAMBLE COMPANY (US) | 1983-08-23 | — | — | US | disclosed |
| EP-0068584-A1 | Boron containing polyphosphonates for the treatment of calcific tumors | THE PROCTER & GAMBLE COMPANY (US) | 1983-01-05 | — | — | EP | disclosed |