⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16821060 | 1.00 | — | — | |
| SCHEMBL1445950 | 0.81 | — | — | |
| SCHEMBL1535248 | 0.79 | — | — | |
| SCHEMBL1313907 | 0.76 | MAPK1 (0.33) | — | |
| SCHEMBL1313910 | 0.76 | MAPK1 (0.33) | — | |
| SCHEMBL1317454 | 0.76 | MAPK1 (0.33) | — | |
| SCHEMBL16722458 | 0.75 | DUT (0.30) | — | |
| SCHEMBL10100262 | 0.74 | — | — | |
| SCHEMBL23042973 | 0.73 | — | — | |
| SCHEMBL14119498 | 0.73 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20150175530-A1 | ANTIBACTERIAL AGENTS | ACHAOGEN, INC. | 2015-06-25 | — | — | US | disclosed |
| US-7763740-B2 | Method for the production of mumbaistatin derivatives | SANOFI-AVENTIS (FR) | 2010-07-27 | — | — | US | disclosed |
| US-20090156836-A1 | METHOD FOR THE PRODUCTION OF MUMBAISTATIN DERIVATIVES | SANOFI-AVENTIS (FR) | 2009-06-18 | — | — | US | disclosed |