⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28035432 | 0.73 | TSHR (0.35) | — | |
| SCHEMBL20849730 | 0.73 | — | — | |
| SCHEMBL16814714 | 0.71 | — | — | |
| SCHEMBL103330 | 0.71 | — | — | |
| SCHEMBL19464458 | 0.71 | CRBN (0.35) | — | |
| SCHEMBL23131142 | 0.69 | — | — | |
| SCHEMBL436255 | 0.69 | — | — | |
| SCHEMBL8382914 | 0.69 | — | — | |
| SCHEMBL23173690 | 0.67 | — | — | |
| SCHEMBL24880608 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2970275-B1 | PROTEIN KINASE C INHIBITORS AND USES THEREOF | RIGEL PHARMACEUTICALS INC (US) | 2018-05-09 | — | — | EP | disclosed |