⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8460149 | 0.69 | — | — | |
| SCHEMBL141782 | 0.67 | HIF1A (0.42) | — | |
| Hydrochloric Acid SCHEMBL27771923 | 0.64 | GNAI3 (0.41) | — | |
| Hydrochloric Acid SCHEMBL2361641 | 0.64 | GNAI3 (0.41) | — | |
| SCHEMBL2708082 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL2386268 | 0.64 | GNAI3 (0.41) | — | |
| Piperazine SCHEMBL7571750 | 0.64 | HIF1A (0.50) | — | |
| SCHEMBL12582617 | 0.64 | — | — | |
| SCHEMBL16877924 | 0.64 | — | — | |
| SCHEMBL25060714 | 0.62 | — | — |
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-6841661-B2 | Glycopeptide antibacterial compounds, compositions containing same and methods of using same | PRINCETON UNIVERISITY (US) | 2005-01-11 | — | — | US | disclosed |
| US-6498238-B1 | Glycopeptide antibacterial compounds, compositions containing same and methods of using same | PRINCETON UNIVERSITY | 2002-12-24 | — | — | US | disclosed |