⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL124664 | 0.92 | — | — | |
| SCHEMBL3699903 | 0.77 | — | — | |
| Phosphoramidic Acid SCHEMBL5176724 | 0.72 | — | — | |
| Phosphoric Acid SCHEMBL28745250 | 0.70 | CA2 (0.39) | — | |
| Phosphoric Acid SCHEMBL15053704 | 0.70 | CA2 (0.39) | — | |
| Phosphoric Acid SCHEMBL814222 | 0.70 | — | — | |
| Phosphoric Acid SCHEMBL10896983 | 0.70 | CA2 (0.39) | — | |
| Phosphoric Acid SCHEMBL181164 | 0.69 | CA2 (0.46) | — | |
| Phosphoric Acid SCHEMBL181165 | 0.69 | — | — | |
| Phosphoric Acid SCHEMBL22658127 | 0.69 | CA2 (0.46) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8916536-B2 | Bone-targeting bisphosphonate duplex drugs | SCHOTT HERBERT (DE) | 2014-12-23 | — | — | US | disclosed |
| EP-2601202-B1 | BONE-TARGETING BISPHOSPHONATE DUPLEX DRUGS | SCHOTT HERBERT (DE) | 2014-09-03 | — | — | EP | disclosed |
| US-20130237494-A1 | BONE-TARGETING BISPHOSPHONATE DUPLEX DRUGS | SCHOTT HERBERT (DE) | 2013-09-12 | — | — | US | disclosed |
| EP-2601202-A1 | BONE-TARGETING BISPHOSPHONATE DUPLEX DRUGS | SCHOTT, Herbert (DE) | 2013-06-12 | — | — | EP | disclosed |
| WO-2012016994-A1 | BONE-TARGETING BISPHOSPHONATE DUPLEX DRUGS | SCHOTT HERBERT (DE) | 2012-02-09 | — | — | WO | disclosed |