⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3582520 | 1.00 | — | — | |
| SCHEMBL3579978 | 0.93 | OPRD1 (0.61) | — | |
| SCHEMBL3579976 | 0.93 | OPRD1 (0.61) | — | |
| SCHEMBL3577855 | 0.90 | — | — | |
| SCHEMBL3577853 | 0.90 | — | — | |
| SCHEMBL13441420 | 0.90 | — | — | |
| SCHEMBL3581245 | 0.88 | OPRD1 (0.55) | — | |
| SCHEMBL3581244 | 0.88 | OPRD1 (0.55) | — | |
| SCHEMBL3580035 | 0.87 | OPRD1 (0.71) | — | |
| SCHEMBL3580032 | 0.87 | OPRD1 (0.71) | — |
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-1874315-A2 | COMPOSITIONS OF NOVEL OPIOID COMPOUNDS AND METHOD OF USE THEREOF | Mount Cook Biosciences, Inc. (US) | 2008-01-09 | — | — | EP | disclosed |
| WO-2006113468-A2 | COMPOSITIONS OF NOVEL OPIOID COMPOUNDS AND METHOD OF USE THEREOF | MOUNT COOK BIOSCIENCES, INC. (US) | 2006-10-26 | — | — | WO | disclosed |