⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6135159 | 1.00 | — | — | |
| SCHEMBL3038217 | 0.97 | EPHX1 (0.32) | — | |
| SCHEMBL6134426 | 0.92 | — | — | |
| SCHEMBL2581093 | 0.78 | — | — | |
| SCHEMBL646385 | 0.78 | — | — | |
| SCHEMBL8676104 | 0.77 | SIGMAR1 (0.39) | — | |
| SCHEMBL11691199 | 0.75 | — | — | |
| SCHEMBL3316839 | 0.74 | — | — | |
| SCHEMBL3163054 | 0.74 | — | — | |
| SCHEMBL61990 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-115052627-A | IRAK degrading agents and uses thereof | 凯麦拉医疗公司 | 2022-09-13 | — | — | CN | disclosed |