⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19128711 | 0.78 | — | — | |
| SCHEMBL90066 | 0.76 | — | — | |
| SCHEMBL16455039 | 0.76 | — | — | |
| SCHEMBL14111108 | 0.76 | — | — | |
| SCHEMBL12312903 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL25346768 | 0.74 | KAT6A (0.31) | — | |
| SCHEMBL3106378 | 0.74 | CCR2 (0.38) | — | |
| Hydrochloric Acid SCHEMBL25346774 | 0.74 | KAT6A (0.31) | — | |
| SCHEMBL10522013 | 0.74 | — | — | |
| SCHEMBL12133101 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103159692-B | Tetrazole-substituted arylamides | HOFFMANN LA ROCHE | 2015-03-18 | — | — | CN | disclosed |
| CN-103214464-B | Tetrazole-substituted arylamides and application of tetrazole-substituted arylamides using as p2x3 and p2x2/3 receptor antagonists | HOFFMANN LA ROCHE | 2015-02-18 | — | — | CN | disclosed |