⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3282529 | 0.88 | PCSK9 (0.42) | — | |
| SCHEMBL3284395 | 0.82 | DNM1L (0.41) | — | |
| SCHEMBL3285038 | 0.80 | HPGD (0.51) | — | |
| SCHEMBL3287737 | 0.79 | TMPRSS15 (0.44) | — | |
| SCHEMBL3288776 | 0.79 | CTSB (0.40) | — | |
| SCHEMBL3289515 | 0.79 | NPC1 (0.57) | — | |
| SCHEMBL3288440 | 0.78 | — | — | |
| SCHEMBL3281633 | 0.78 | POLB (0.43) | — | |
| SCHEMBL3281631 | 0.78 | MEN1 (0.51) | — | |
| SCHEMBL3288904 | 0.77 | HRH3 (0.43) | — |
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-7709503-B2 | Pyrrol derivatives with antibacterial activity | ASTRAZENECA AB (SE) | 2010-05-04 | — | — | US | disclosed |
| EP-1664025-B1 | PYRROL DERIVATIVES WITH ANTIBACTERIAL ACTIVITY | ASTRAZENECA AB (SE) | 2007-09-19 | — | — | EP | disclosed |
| US-20060223801-A1 | Pyrrol derivatives with antibacterial activity | ASTRAZENECA AB (SE) | 2006-10-05 | — | — | US | disclosed |