⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21096814 | 0.77 | FAAH (0.46) | — | |
| SCHEMBL24773851 | 0.76 | — | — | |
| SCHEMBL25698365 | 0.76 | KDM4E (0.33) | — | |
| SCHEMBL24340877 | 0.76 | — | — | |
| SCHEMBL25698379 | 0.75 | KDM4E (0.39) | — | |
| SCHEMBL21151855 | 0.73 | ACACB (0.33) | — | |
| SCHEMBL23896719 | 0.73 | ACACB (0.33) | — | |
| SCHEMBL6036335 | 0.72 | KDM4E (0.36) | — | |
| SCHEMBL18359242 | 0.70 | KDM4E (0.45) | — | |
| SCHEMBL19245413 | 0.69 | MEN1 (0.35) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2680889-B1 | RADIOLABELLED OCTREOTATE ANALOGUES AS PET TRACERS | GE HEALTHCARE LTD (GB) | 2019-06-19 | — | — | EP | disclosed |