⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL329247 | 0.71 | — | — | |
| Water SCHEMBL4367432 | 0.69 | — | — | |
| SCHEMBL8004754 | 0.67 | — | — | |
| SCHEMBL29213684 | 0.67 | — | — | |
| SCHEMBL4357454 | 0.63 | — | — | |
| SCHEMBL667536 | 0.59 | GAA (0.34) | — | |
| SCHEMBL29171754 | 0.59 | — | — | |
| Iodide SCHEMBL28936713 | 0.57 | — | — | |
| Iodide SCHEMBL28706662 | 0.57 | — | — | |
| SCHEMBL19458339 | 0.54 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2167491-A1 | 5-HETEROARYL SUBSTITUTED INDAZOLES AS KINASE INHIBITORS | Abbott Laboratories (US) | 2010-03-31 | — | — | EP | disclosed |
| WO-2008154241-A1 | 5-HETEROARYL SUBSTITUTED INDAZOLES AS KINASE INHIBITORS | ABBOTT LABORATORIES (US) | 2008-12-18 | — | — | WO | disclosed |