⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26024079 | 1.00 | — | — | |
| SCHEMBL24816350 | 0.83 | — | — | |
| SCHEMBL26024125 | 0.83 | — | — | |
| SCHEMBL24007993 | 0.83 | — | — | |
| SCHEMBL24007759 | 0.81 | EPHX2 (0.31) | — | |
| SCHEMBL24007991 | 0.79 | ALDH1A1 (0.33) | — | |
| SCHEMBL24815030 | 0.79 | — | — | |
| SCHEMBL24008152 | 0.79 | — | — | |
| SCHEMBL24814042 | 0.79 | — | — | |
| SCHEMBL25746133 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021226261-A1 | 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS | AJAX THERAPEUTICS, INC. (US) | 2021-11-11 | — | — | WO | disclosed |