⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24814038 | 1.00 | — | — | |
| SCHEMBL260593 | 1.00 | — | — | |
| SCHEMBL7091680 | 1.00 | — | — | |
| SCHEMBL7091682 | 1.00 | — | — | |
| SCHEMBL10433294 | 1.00 | — | — | |
| SCHEMBL27786042 | 0.97 | — | — | |
| Ethane SCHEMBL27566965 | 0.95 | CA1 (0.50) | — | |
| Ethyne SCHEMBL8517660 | 0.95 | CA1 (0.44) | — | |
| SCHEMBL17679762 | 0.94 | — | — | |
| SCHEMBL18462018 | 0.94 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230265075-A1 | 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS | AJAX THERAPEUTICS, INC. | 2023-08-24 | — | — | US | disclosed |