⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15085712 | 1.00 | — | — | |
| SCHEMBL14655233 | 0.82 | MCL1 (0.45) | — | |
| SCHEMBL1755576 | 0.80 | — | — | |
| SCHEMBL25381357 | 0.78 | — | — | |
| SCHEMBL14220485 | 0.78 | — | — | |
| SCHEMBL5907619 | 0.78 | — | — | |
| SCHEMBL13780272 | 0.77 | MCL1 (0.39) | — | |
| SCHEMBL402417 | 0.77 | GRIK1 (0.47) | — | |
| SCHEMBL1512966 | 0.77 | GRIK1 (0.47) | — | |
| SCHEMBL13780275 | 0.77 | MCL1 (0.39) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017046606-A1 | ANTIBACTERIAL COMPOUNDS | REDX PHARMA PLC (GB) | 2017-03-23 | — | — | WO | disclosed |