⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL362734 | 0.63 | ALDH1A1 (0.33) | — | |
| SCHEMBL3390027 | 0.59 | — | — | |
| SCHEMBL3502241 | 0.59 | — | — | |
| SCHEMBL4939818 | 0.59 | — | — | |
| SCHEMBL15943716 | 0.58 | — | — | |
| SCHEMBL2679603 | 0.55 | — | — | |
| SCHEMBL5246233 | 0.55 | — | — | |
| SCHEMBL3673703 | 0.53 | — | — | |
| SCHEMBL11171567 | 0.53 | — | — | |
| SCHEMBL173513 | 0.51 | — | — |
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-3216820-A1 | POLYARYLETHER KETONE IMIDE SULFONE ADHESIVES | The Boeing Company (US) | 2017-09-13 | — | — | EP | disclosed |
| WO-2011030068-A1 | USE OF INDOLE DERIVATIVES AS NURR-1 ACTIVATORS FOR THE APPLICATION THEREOF AS A MEDICAMENT FOR THE TREATMENT OF PARKINSON'S DISEASE | LABORATOIRES FOURNIER SA (FR) | 2011-03-17 | — | — | WO | disclosed |
| EP-2258399-A2 | Multivalent VLA-4 antagonists comprising polymer moieties | Elan Pharmaceuticals Inc. (US) | 2010-12-08 | — | — | EP | disclosed |