⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7633090 | 0.72 | — | — | |
| SCHEMBL14221296 | 0.72 | KDM4E (0.32) | — | |
| SCHEMBL24679122 | 0.70 | — | — | |
| SCHEMBL7740505 | 0.69 | — | — | |
| SCHEMBL10073391 | 0.69 | — | — | |
| SCHEMBL13180964 | 0.69 | — | — | |
| SCHEMBL2310070 | 0.69 | — | — | |
| SCHEMBL15630607 | 0.69 | — | — | |
| SCHEMBL7877576 | 0.69 | — | — | |
| SCHEMBL8472435 | 0.68 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022012550-A1 | SUBSTITUTED 1H-IMIDAZO [1, 2-B] PYRAZOLE-3-CARBOXAMIDE AS BRUTON'S TYROSINE KINASE INHIBITORS | HENAN NORMAL UNIVERSITY (CN) | 2022-01-20 | — | — | WO | disclosed |
| EP-1667971-B1 | FEXOFENADINE POLYMORPHS AND PROCESSES OF PREPARING THE SAME | CIPLA LTD (IN) | 2012-06-20 | — | — | EP | disclosed |