⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17174420 | 0.84 | — | — | |
| SCHEMBL19300150 | 0.84 | — | — | |
| SCHEMBL1099053 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL29920143 | 0.82 | — | — | |
| SCHEMBL12548066 | 0.78 | FUCA1 (0.30) | — | |
| SCHEMBL12548492 | 0.71 | — | — | |
| SCHEMBL27377477 | 0.70 | — | — | |
| SCHEMBL14506011 | 0.67 | — | — | |
| SCHEMBL9112845 | 0.67 | — | — | |
| SCHEMBL8226017 | 0.67 | — | — |
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-2023131271-A1 | PYRROLE FUSED-RING PYRAZOLE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 杭州中美华东制药有限公司 | 2023-07-13 | — | — | WO | disclosed |
| EP-2935244-B1 | NOVEL BENZIMIDAZOLE DERIVATIVES AS KINASE INHIBITORS | SELVITA S A (PL) | 2018-06-27 | — | — | EP | disclosed |