⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10901955 | 0.84 | — | — | |
| SCHEMBL10902020 | 0.82 | GPR84 (0.47) | — | |
| SCHEMBL10904485 | 0.80 | GPR84 (0.50) | — | |
| SCHEMBL10903731 | 0.80 | GPR84 (0.50) | — | |
| SCHEMBL2143102 | 0.79 | — | — | |
| SCHEMBL2143097 | 0.79 | — | — | |
| SCHEMBL6436151 | 0.78 | — | — | |
| SCHEMBL269635 | 0.77 | — | — | |
| SCHEMBL336165 | 0.76 | — | — | |
| SCHEMBL15341510 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-106255882-A | For the method and apparatus detecting Pseudomonas aeruginosa | 耶路撒冷希伯来大学伊森姆研究发展公司 | 2016-12-21 | — | — | CN | disclosed |