⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19031995 | 0.96 | — | — | |
| SCHEMBL31377549 | 0.94 | — | — | |
| SCHEMBL19032018 | 0.94 | — | — | |
| SCHEMBL14573483 | 0.94 | — | — | |
| SCHEMBL9816260 | 0.83 | — | — | |
| SCHEMBL5894132 | 0.63 | CRBN (0.33) | — | |
| SCHEMBL30731364 | 0.62 | ALDH1A1 (0.32) | — | |
| SCHEMBL1199564 | 0.60 | — | — | |
| SCHEMBL8296759 | 0.58 | — | — | |
| SCHEMBL7584628 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2649048-A1 | MULTIFUNCTIONAL NITROXIDE DERIVATIVES AND USES THEREOF | Radikal Therapeutics Inc. (US) | 2013-10-16 | — | — | EP | disclosed |
| WO-2012077108-A1 | MULTIFUNCTIONAL NITROXIDE DERIVATIVES AND USES THEREOF | RADIKAL THERAPEUTICS INC. (US) | 2012-06-14 | — | — | WO | disclosed |