⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5887657 | 0.78 | — | — | |
| SCHEMBL17536800 | 0.73 | — | — | |
| SCHEMBL3636714 | 0.73 | — | — | |
| SCHEMBL6986884 | 0.73 | — | — | |
| SCHEMBL15055208 | 0.69 | — | — | |
| SCHEMBL4753612 | 0.69 | — | — | |
| SCHEMBL4268111 | 0.68 | — | — | |
| SCHEMBL18825615 | 0.68 | — | — | |
| SCHEMBL18682996 | 0.67 | — | — | |
| SCHEMBL8076950 | 0.66 | — | — |
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-2010020307-A2 | INDAZOLE-5-CARBOXYLIC ACID HYDRAZIDE DERIVATIVES | MERCK PATENT GMBH (DE) | 2010-02-25 | — | — | WO | disclosed |