⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11564239 | 0.74 | — | — | |
| SCHEMBL12725948 | 0.69 | — | — | |
| SCHEMBL25543213 | 0.67 | — | — | |
| SCHEMBL2338033 | 0.66 | SMN1; SMN2 (0.41) | — | |
| SCHEMBL30214 | 0.65 | TGFBR1 (0.44) | — | |
| SCHEMBL366041 | 0.65 | — | — | |
| SCHEMBL9067167 | 0.64 | LMNA (0.35) | — | |
| SCHEMBL11016623 | 0.64 | — | — | |
| SCHEMBL18509649 | 0.64 | — | — | |
| SCHEMBL7802686 | 0.64 | LMNA (0.35) | — |
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-2015164614-A1 | JANUS KINASE INHIBITORS AND USES THEREOF | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2015-10-29 | — | — | WO | disclosed |