⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20230753 | 0.76 | — | — | |
| SCHEMBL12367755 | 0.68 | — | — | |
| SCHEMBL1248261 | 0.64 | — | — | |
| SCHEMBL12548068 | 0.63 | — | — | |
| SCHEMBL7031276 | 0.62 | — | — | |
| SCHEMBL10306548 | 0.62 | — | — | |
| SCHEMBL22433363 | 0.62 | — | — | |
| SCHEMBL7884731 | 0.62 | — | — | |
| SCHEMBL21812104 | 0.62 | — | — | |
| SCHEMBL21917477 | 0.62 | — | — |
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-2970163-B1 | 5-THIAZOLECARBOXAMIDE DERVATIVES AND THEIR USE AS BTK INHIBITORS | BOEHRINGER INGELHEIM INT (DE) | 2018-02-28 | — | — | EP | disclosed |