⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL842706 | 0.75 | — | — | |
| SCHEMBL2612030 | 0.73 | ALDH1A1 (0.41) | — | |
| SCHEMBL104505 | 0.73 | — | — | |
| SCHEMBL842902 | 0.71 | — | — | |
| SCHEMBL1536952 | 0.71 | HMGCR (0.43) | — | |
| SCHEMBL7041938 | 0.71 | HMGCR (0.58) | — | |
| SCHEMBL28494 | 0.71 | — | — | |
| SCHEMBL8723277 | 0.71 | — | — | |
| SCHEMBL16662440 | 0.69 | ALDH1A1 (0.44) | — | |
| SCHEMBL12894891 | 0.69 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8946144-B2 | Phosphonated glycopeptide and lipoglycopeptide antibiotics and uses thereof for the prevention and treatment of bone and joint infections | THE MEDICINES COMPANY (US) | 2015-02-03 | — | — | US | disclosed |
| US-20100113333-A1 | PHOSPHONATED GLYCOPEPTIDE AND LIPOGLYCOPEPTIDE ANTIBIOTICS AND USES THEREOF FOR THE PREVENTION AND TREATMENT OF BONE AND JOINT INFECTIONS | TARGANTA THERAPEUTICS, INC. (CA) | 2010-05-06 | — | — | US | disclosed |