⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14724756 | 0.78 | — | — | |
| SCHEMBL13716503 | 0.78 | — | — | |
| SCHEMBL13456825 | 0.78 | — | — | |
| SCHEMBL10453987 | 0.78 | — | — | |
| SCHEMBL16359271 | 0.78 | — | — | |
| SCHEMBL14646604 | 0.78 | — | — | |
| SCHEMBL19074386 | 0.76 | — | — | |
| SCHEMBL14326990 | 0.75 | — | — | |
| SCHEMBL9071086 | 0.75 | — | — | |
| SCHEMBL14547253 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2385980-B1 | BACTERIAL VACCINES WITH CELL WALL-ASSOCIATED CERAMIDE-LIKE GLYCOLIPIDS AND USES THEREOF | ALBERT EINSTEIN COLLEGE MEDICINE INC (US) | 2018-04-18 | — | — | EP | disclosed |
| US-20140147754-A1 | MAGNESIUM BATTERY ELECTROLYTE | SHANGHAI JIAO TONG UNIVERSITY (CN) | 2014-05-29 | — | — | US | disclosed |
| EP-1481077-B1 | MITOTIC KINESIN INHIBITORS | MERCK & CO INC (US) | 2009-11-04 | — | — | EP | disclosed |