⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17307631 | 0.78 | PDE1A (0.33) | — | |
| SCHEMBL4424869 | 0.75 | CCNB2 (0.31) | — | |
| SCHEMBL2629342 | 0.75 | — | — | |
| SCHEMBL15229474 | 0.73 | — | — | |
| SCHEMBL22792609 | 0.73 | — | — | |
| SCHEMBL873971 | 0.73 | — | — | |
| SCHEMBL8566607 | 0.73 | — | — | |
| SCHEMBL5833261 | 0.73 | — | — | |
| SCHEMBL5540227 | 0.73 | — | — | |
| SCHEMBL5535219 | 0.71 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9795608-B2 | Protein kinase inhibitors | PHARMASCIENCE, INC. (CA) | 2017-10-24 | — | — | US | disclosed |
| EP-2870158-B1 | 1-[4-(3-PHENOXY)-PHENYL]-1H-PYRAZOLO[4,3-D]PYRIMIDIN-7-YL-AMINE DERIVATIVES AS BRUTON'S TYROSINE KINASE (BTK) INHIBITORS FOR THE TREATMENT OF E.G. PROLIFERATIVE DISEASES | PHARMASCIENCE INC (CA) | 2017-05-31 | — | — | EP | disclosed |
| US-9447102-B2 | Protein kinase inhibitors | PHARMASCIENCE, INC. (CA) | 2016-09-20 | — | — | US | disclosed |
| US-20150344478-A1 | PROTEIN KINASE INHIBITORS | GB005, INC. | 2015-12-03 | — | — | US | disclosed |