⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3912391 | 0.90 | NPC1 (0.32) | — | |
| SCHEMBL4123671 | 0.85 | SIGMAR1 (0.33) | — | |
| SCHEMBL5707113 | 0.83 | CYP2D6 (0.33) | — | |
| SCHEMBL24027743 | 0.82 | CYP1A2 (0.42) | — | |
| Ammonia Solution, Strong SCHEMBL6129171 | 0.81 | CYP2D6 (0.32) | — | |
| SCHEMBL28591684 | 0.77 | ALDH1A1 (0.32) | — | |
| SCHEMBL19101444 | 0.77 | — | — | |
| SCHEMBL6367927 | 0.77 | CYP2D6 (0.37) | — | |
| SCHEMBL24811711 | 0.74 | — | — | |
| SCHEMBL21214182 | 0.74 | ALOX15 (0.50) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8022113-B2 | Composition containing aziridino groups and use thereof | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2011-09-20 | — | — | US | disclosed |
| US-8022113-B2 | Composition containing aziridino groups and use thereof | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2011-09-20 | — | — | US | disclosed |
| EP-1984427-B1 | COMPOSITION CONTAINING AZIRIDINO GROUPS AND USE THEREOF | 3M INNOVATIVE PROPERTIES CO (US) | 2009-10-28 | — | — | EP | disclosed |
| EP-1984427-B1 | COMPOSITION CONTAINING AZIRIDINO GROUPS AND USE THEREOF | 3M INNOVATIVE PROPERTIES CO (US) | 2009-10-28 | — | — | EP | disclosed |
| US-20090068619-A1 | COMPOSITION CONTAINING AZIRIDINO GROUPS AND USE THEREOF | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2009-03-12 | — | — | US | disclosed |
| US-20090068619-A1 | COMPOSITION CONTAINING AZIRIDINO GROUPS AND USE THEREOF | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2009-03-12 | — | — | US | disclosed |
| EP-1984427-A1 | COMPOSITION CONTAINING AZIRIDINO GROUPS AND USE THEREOF | 3M Innovative Properties Company (US) | 2008-10-29 | — | — | EP | disclosed |
| WO-2007097921-A1 | COMPOSITION CONTAINING AZIRIDINO GROUPS AND USE THEREOF | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2007-08-30 | — | — | WO | disclosed |
| WO-2007097921-A1 | COMPOSITION CONTAINING AZIRIDINO GROUPS AND USE THEREOF | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2007-08-30 | — | — | WO | disclosed |
| EP-1820815-A1 | Composition containing aziridino groups and use thereof | 3M Innovative Properties Company (US) | 2007-08-22 | — | — | EP | disclosed |
| EP-1820815-A1 | Composition containing aziridino groups and use thereof | 3M Innovative Properties Company (US) | 2007-08-22 | — | — | EP | disclosed |