⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19608459 | 0.91 | — | — | |
| SCHEMBL16877558 | 0.71 | — | — | |
| SCHEMBL16878474 | 0.71 | — | — | |
| SCHEMBL16878635 | 0.71 | — | — | |
| SCHEMBL22147394 | 0.67 | — | — | |
| SCHEMBL16877669 | 0.67 | — | — | |
| SCHEMBL16878156 | 0.67 | PNMT (0.32) | — | |
| SCHEMBL30059264 | 0.67 | CXCR4 (0.50) | — | |
| SCHEMBL16878018 | 0.67 | CXCR4 (0.35) | — | |
| SCHEMBL24717802 | 0.67 | MAPK1 (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 |
|---|---|---|---|---|---|---|---|
| US-20180105531-A1 | METHODS AND COMPOSITIONS FOR INHIBITING THE INTERACTION OF MENIN WITH MLL PROTEINS | WELLSPRING BIOSCIENCES LLC | 2018-04-19 | — | — | US | disclosed |