⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28719406 | 1.00 | — | — | |
| SCHEMBL12281861 | 1.00 | — | — | |
| SCHEMBL1630761 | 0.76 | CHRNB2 (0.44) | — | |
| SCHEMBL1630764 | 0.76 | CHRNB2 (0.44) | — | |
| SCHEMBL2486077 | 0.76 | CHRNB2 (0.44) | — | |
| SCHEMBL14311002 | 0.76 | — | — | |
| SCHEMBL8742304 | 0.76 | — | — | |
| SCHEMBL10033452 | 0.76 | — | — | |
| SCHEMBL22881957 | 0.74 | — | — | |
| SCHEMBL5698674 | 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210079004-A1 | PROCESS FOR PREPARING BTK INHIBITORS | GENENTECH, INC. (US) | 2021-03-18 | — | — | US | disclosed |
| US-10882864-B2 | Process for preparing BTK inhibitors | GENENTECH, INC. (US) | 2021-01-05 | — | — | US | disclosed |
| US-20200062762-A1 | PROCESS FOR PREPARING BTK INHIBITORS | GENENTECH, INC. (US) | 2020-02-27 | — | — | US | disclosed |
| US-10385058-B2 | Process for preparing BTK inhibitors | GENENTECH, INC. (US) | 2019-08-20 | — | — | US | disclosed |
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |