⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7492414 | 1.00 | — | — | |
| SCHEMBL7492412 | 1.00 | — | — | |
| SCHEMBL14299723 | 0.79 | — | — | |
| SCHEMBL6676961 | 0.76 | — | — | |
| SCHEMBL583681 | 0.72 | — | — | |
| SCHEMBL6650892 | 0.71 | — | — | |
| SCHEMBL15289894 | 0.69 | — | — | |
| SCHEMBL18736736 | 0.69 | — | — | |
| SCHEMBL14959370 | 0.67 | MEN1 (0.32) | — | |
| SCHEMBL19073812 | 0.67 | MEN1 (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 |
|---|---|---|---|---|---|---|---|
| US-20180134724-A1 | METHODS AND INTERMEDIATES FOR THE PREPARATION OF OMACETAXINE AND CEPHALOTAXINE DERIVATIVES THEREOF | CURIA BUFFALO R&D, LLC | 2018-05-17 | — | — | US | disclosed |