⚠ 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 | |
|---|---|---|---|---|
| Phosphonic Acid SCHEMBL309982 | 1.00 | — | — | |
| Phosphonic Acid SCHEMBL5701286 | 1.00 | — | — | |
| Phosphonic Acid SCHEMBL5174404 | 1.00 | — | — | |
| Phosphonic Acid SCHEMBL25330767 | 0.94 | — | — | |
| Phosphonic Acid SCHEMBL5468942 | 0.94 | — | — | |
| Phosphonic Acid SCHEMBL28959519 | 0.94 | — | — | |
| Phosphonic Acid SCHEMBL7742187 | 0.94 | — | — | |
| Phosphonic Acid SCHEMBL5470708 | 0.94 | — | — | |
| Phosphonic Acid SCHEMBL15572223 | 0.94 | — | — | |
| Phosphonic Acid SCHEMBL11337542 | 0.94 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1994026279-A1 | BISPHOSPHONATE ESTERS FOR TREATING GASTRIC DISORDERS | THE UPJOHN COMPANY (US) | 1994-11-24 | — | — | WO | claimed |
| CN-112321636-B | Preparation method of antibiotic intermediate | 无锡德方生物科技有限公司 | 2022-05-27 | — | — | CN | disclosed |
| CN-112375098-A | Application of carbonate-borane catalyst in preparation of antibiotic intermediate | 商河探荣新技术开发中心 | 2021-02-19 | — | — | CN | disclosed |
| CN-112321636-A | Preparation method of antibiotic intermediate | 商河探荣新技术开发中心 | 2021-02-05 | — | — | CN | disclosed |
| US-5824661-A | TREATMENT OF OSTEOPOROSIS, OSTEOARTHRITIS, RHEUMATOID ARTHRITIS | THE PROCTER & GAMBLE COMPANY (US) | 1998-10-20 | — | — | US | disclosed |
| WO-1994026279-A1 | BISPHOSPHONATE ESTERS FOR TREATING GASTRIC DISORDERS | THE UPJOHN COMPANY (US) | 1994-11-24 | — | — | WO | disclosed |