⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9114861 | 0.81 | — | — | |
| SCHEMBL9858368 | 0.76 | MGAM (0.35) | — | |
| SCHEMBL9858369 | 0.76 | MGAM (0.35) | — | |
| SCHEMBL14993757 | 0.75 | KEAP1 (0.35) | — | |
| SCHEMBL14390244 | 0.74 | — | — | |
| SCHEMBL9143771 | 0.74 | — | — | |
| SCHEMBL8767596 | 0.69 | AKR1B1 (0.31) | — | |
| SCHEMBL361553 | 0.66 | — | — | |
| SCHEMBL1149440 | 0.66 | — | — | |
| SCHEMBL172436 | 0.62 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9126965-B1 | Process for preparing morphine compounds | BROCK UNIVERSITY (CA) | 2015-09-08 | — | — | US | disclosed |
| US-9126965-B1 | Process for preparing morphine compounds | BROCK UNIVERSITY (CA) | 2015-09-08 | — | — | US | disclosed |
| US-20150239860-A1 | PROCESS FOR PREPARING MORPHINE COMPOUNDS | BROCK UNIVERSITY (CA) | 2015-08-27 | — | — | US | disclosed |
| US-20150239860-A1 | PROCESS FOR PREPARING MORPHINE COMPOUNDS | BROCK UNIVERSITY (CA) | 2015-08-27 | — | — | US | disclosed |