⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29480651 | 0.88 | — | — | |
| SCHEMBL22735766 | 0.79 | GRM4 (0.31) | — | |
| SCHEMBL22735769 | 0.78 | EGLN1 (0.33) | — | |
| SCHEMBL22735954 | 0.78 | EGLN1 (0.34) | — | |
| SCHEMBL29480652 | 0.78 | EGLN1 (0.34) | — | |
| SCHEMBL29480668 | 0.77 | EGLN1 (0.38) | — | |
| SCHEMBL22736533 | 0.77 | EGLN1 (0.38) | — | |
| SCHEMBL29480720 | 0.77 | EGLN1 (0.37) | — | |
| SCHEMBL22736126 | 0.77 | EGLN1 (0.37) | — | |
| SCHEMBL29567604 | 0.76 | RPS6KB1 (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 |
|---|---|---|---|---|---|---|---|
| WO-2020240586-A1 | NOVEL COMPOUNDS FOR INHIBITION OF JANUS KINASE 1 | MANKIND PHARMA LTD. (IN) | 2020-12-03 | — | — | WO | disclosed |