⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4668436 | 0.83 | — | — | |
| SCHEMBL2222142 | 0.78 | — | — | |
| SCHEMBL68459 | 0.76 | — | — | |
| SCHEMBL17935679 | 0.76 | TSHR (0.46) | — | |
| SCHEMBL4108693 | 0.76 | TSHR (0.52) | — | |
| SCHEMBL24720909 | 0.74 | TSHR (0.44) | — | |
| SCHEMBL1457368 | 0.74 | TSHR (0.44) | — | |
| SCHEMBL30440232 | 0.74 | — | — | |
| SCHEMBL30007313 | 0.74 | — | — | |
| SCHEMBL6829811 | 0.74 | — | — |
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-1996026939-A1 | CARBAPENEM COMPOUNDS, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-09-06 | — | — | WO | disclosed |
| US-5246508-A | Uniform composite in a hypermonotectic alloy system and a method for producing the same | VANDERBILT UNIVERSITY (US) | 1993-09-21 | — | — | US | disclosed |