⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1842598 | 0.75 | L3MBTL1 (0.32) | — | |
| SCHEMBL1842599 | 0.75 | L3MBTL1 (0.32) | — | |
| SCHEMBL1653916 | 0.75 | — | — | |
| SCHEMBL2470886 | 0.75 | PPP5C (0.31) | — | |
| SCHEMBL2470889 | 0.75 | PPP5C (0.31) | — | |
| SCHEMBL12721296 | 0.75 | EPHX2 (0.35) | — | |
| SCHEMBL572647 | 0.74 | OPRM1 (0.33) | — | |
| SCHEMBL572648 | 0.74 | OPRM1 (0.33) | — | |
| SCHEMBL18642001 | 0.74 | — | — | |
| SCHEMBL10597822 | 0.73 | NAAA (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010132760-A9 | ANTIBACTERIAL DERIVATIVES OF TOBRAMYCIN | ACHAOGEN, INC. (US) | 2011-11-03 | — | — | WO | disclosed |
| WO-2010132768-A9 | ANTIBACTERIAL DERIVATIVES OF SISOMICIN | ACHAOGEN, INC. (US) | 2011-09-15 | — | — | WO | disclosed |