⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1678167 | 0.81 | — | — | |
| SCHEMBL27748149 | 0.78 | — | — | |
| Ammonia Solution, Strong SCHEMBL3395675 | 0.78 | — | — | |
| Iodide SCHEMBL7028839 | 0.78 | — | — | |
| SCHEMBL358406 | 0.77 | — | — | |
| SCHEMBL18969667 | 0.75 | TSHR (0.35) | — | |
| SCHEMBL13757685 | 0.71 | TSHR (0.39) | — | |
| SCHEMBL20648613 | 0.71 | — | — | |
| SCHEMBL13771199 | 0.71 | — | — | |
| SCHEMBL14509762 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103159692-B | Tetrazole-substituted arylamides | HOFFMANN LA ROCHE | 2015-03-18 | — | — | CN | disclosed |
| CN-103159692-A | Tetrazole-substituted arylamides | HOFFMANN LA ROCHE | 2013-06-19 | — | — | CN | disclosed |
| CN-101479250-B | Tetrazole-substituted arylamides | HOFFMANN LA ROCHE | 2013-05-22 | — | — | CN | disclosed |
| CN-101479250-A | Tetrazole-substituted arylamides | HOFFMANN LA ROCHE (CH) | 2009-07-08 | — | — | CN | disclosed |