⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13997797 | 0.89 | CA1 (0.32) | — | |
| SCHEMBL27269583 | 0.85 | — | — | |
| SCHEMBL6806038 | 0.77 | KDM4E (0.33) | — | |
| SCHEMBL3248168 | 0.76 | SLC6A3 (0.41) | — | |
| SCHEMBL1650151 | 0.74 | SLC6A3 (0.40) | — | |
| SCHEMBL6944976 | 0.72 | MEN1 (0.36) | — | |
| SCHEMBL2284208 | 0.71 | ALDH1A1 (0.41) | — | |
| SCHEMBL1408997 | 0.71 | SIGMAR1 (0.39) | — | |
| SCHEMBL3932573 | 0.70 | GPR84 (0.40) | — | |
| SCHEMBL15546025 | 0.69 | PHGDH (0.36) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7919517-B2 | Indazole derivatives | KYOWA HAKKO KIRIN CO., LTD. (JP) | 2011-04-05 | — | — | US | disclosed |
| US-20090082348-A1 | INDAZOLE DERIVATIVES | KYOWA HAKKO KOGYO CO., LTD. (JP) | 2009-03-26 | — | — | US | disclosed |
| US-7470717-B2 | Indazole derivatives | KYOWA HAKKO KOGYO CO., LTD. (JP) | 2008-12-30 | — | — | US | disclosed |
| US-20070117856-A1 | Indazole derivatives | KYOWA HAKKO KOGYO CO., LTD. (JP) | 2007-05-24 | — | — | US | disclosed |