⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4602157 | 0.90 | — | — | |
| SCHEMBL16972739 | 0.87 | — | — | |
| SCHEMBL4602942 | 0.87 | — | — | |
| SCHEMBL7172832 | 0.71 | — | — | |
| SCHEMBL5855794 | 0.69 | RAB9A (0.32) | — | |
| SCHEMBL7369717 | 0.67 | — | — | |
| SCHEMBL7695953 | 0.67 | — | — | |
| SCHEMBL4667202 | 0.67 | — | — | |
| SCHEMBL2016934 | 0.66 | — | — | |
| SCHEMBL144007 | 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 |
|---|---|---|---|---|---|---|---|
| EP-1940390-A2 | ANTIBACTERIAL PYRROLS | Aston University (GB) | 2008-07-09 | — | — | EP | disclosed |
| WO-2007039749-A2 | ANTIBACTERIAL PYRROLS | ASTON UNIVERSITY (GB) | 2007-04-12 | — | — | WO | disclosed |