⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4228653 | 0.77 | — | — | |
| SCHEMBL5786620 | 0.60 | — | — | |
| SCHEMBL5435524 | 0.55 | — | — | |
| SCHEMBL15555231 | 0.43 | — | — | |
| Lindane SCHEMBL21246973 | 0.41 | LMNA (0.39) | — | |
| SCHEMBL6048993 | 0.38 | — | — | |
| SCHEMBL4354634 | 0.38 | — | — | |
| SCHEMBL11692747 | 0.32 | — | — | |
| SCHEMBL3676206 | 0.32 | — | — | |
| SCHEMBL3837177 | 0.32 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008075007-A1 | MORPHOLINO-SUBSTITUTED BICYCLOHETEROARYL COMPOUNDS AND THEIR USE AS ANTI CANCER AGENTS | CANCER RESEARCH TECHNOLOGY LIMITED (GB) | 2008-06-26 | — | — | WO | disclosed |