⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28881697 | 0.80 | — | — | |
| SCHEMBL8721757 | 0.77 | — | — | |
| SCHEMBL2633391 | 0.76 | — | — | |
| SCHEMBL1680349 | 0.76 | — | — | |
| SCHEMBL542127 | 0.76 | — | — | |
| SCHEMBL23332692 | 0.76 | — | — | |
| SCHEMBL1369329 | 0.76 | — | — | |
| SCHEMBL25078495 | 0.76 | — | — | |
| SCHEMBL18291449 | 0.76 | — | — | |
| SCHEMBL7981810 | 0.76 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022098812-A1 | METHODS OF TREATING IRON OVERLOAD | KEROS THERAPEUTICS, INC. (US) | 2022-05-12 | — | — | WO | disclosed |
| EP-1937664-B1 | HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME | SUMITOMO CHEMICAL CO (JP) | 2011-06-15 | — | — | EP | disclosed |
| WO-2002066425-A2 | COMPOSITIONS AND METHODS FOR HYDRATION OF TERMINAL ALKYNES | SAN DIEGO STATE UNIVERSITY FOUNDATION (US) | 2002-08-29 | — | — | WO | disclosed |