⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27677607 | 0.78 | — | — | |
| SCHEMBL14404657 | 0.77 | — | — | |
| SCHEMBL22280167 | 0.77 | — | — | |
| SCHEMBL15710431 | 0.72 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL371204 | 0.70 | — | — | |
| SCHEMBL15710986 | 0.70 | HDAC2 (0.39) | — | |
| SCHEMBL7280195 | 0.68 | NPC1 (0.33) | — | |
| SCHEMBL9848726 | 0.67 | — | — | |
| SCHEMBL22280216 | 0.66 | HDAC2 (0.63) | — | |
| SCHEMBL11214566 | 0.66 | MCL1 (0.30) | — |
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-2008070891-A1 | LIGANDS FOR THE MODULATION OF ECDYSONE RECEPTORS AND CONTROL OF INSECT GROWTH | COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) | 2008-06-19 | — | — | WO | disclosed |