⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL861862 | 0.78 | — | — | |
| SCHEMBL12417886 | 0.77 | — | — | |
| SCHEMBL13400215 | 0.69 | CA2 (0.36) | — | |
| SCHEMBL22265814 | 0.68 | — | — | |
| SCHEMBL2878537 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL34468684 | 0.65 | — | — | |
| SCHEMBL4922033 | 0.65 | — | — | |
| SCHEMBL42359 | 0.65 | — | — | |
| SCHEMBL20917390 | 0.65 | — | — | |
| SCHEMBL3634162 | 0.64 | — | — |
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-7989430-B2 | Antibacterial agents | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2011-08-02 | — | — | US | disclosed |
| US-20080293666-A1 | Antibacterial Agents | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2008-11-27 | — | — | US | disclosed |