⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8967101 | 0.75 | — | — | |
| SCHEMBL1653665 | 0.70 | — | — | |
| SCHEMBL1653664 | 0.70 | — | — | |
| SCHEMBL6902033 | 0.70 | — | — | |
| SCHEMBL6902032 | 0.70 | — | — | |
| SCHEMBL336093 | 0.67 | — | — | |
| SCHEMBL336092 | 0.67 | — | — | |
| SCHEMBL6810515 | 0.67 | — | — | |
| SCHEMBL6810514 | 0.67 | — | — | |
| SCHEMBL5853081 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1714977-B1 | Synthesis of cyclosporin analogs | ISOTECHNIKA INC (CA) | 2009-03-11 | — | — | EP | claimed |