⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1926000 | 1.00 | — | — | |
| SCHEMBL20859524 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL3083748 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL1025427 | 0.97 | — | — | |
| SCHEMBL14451085 | 0.77 | — | — | |
| SCHEMBL1221414 | 0.77 | — | — | |
| SCHEMBL21416355 | 0.76 | KDM1A (0.30) | — | |
| SCHEMBL8527507 | 0.75 | — | — | |
| SCHEMBL11208526 | 0.75 | — | — | |
| SCHEMBL12967162 | 0.75 | — | — |
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-20210121496-A1 | METHODS AND COMPOSITIONS FOR MODULATING CANCER STEM CELLS | EpiAxis Therapeutics Pty Ltd. (AU) | 2021-04-29 | — | — | US | disclosed |