⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27985176 | 1.00 | — | — | |
| SCHEMBL8733534 | 0.78 | BIRC2 (0.44) | — | |
| SCHEMBL27962911 | 0.78 | BIRC2 (0.33) | — | |
| SCHEMBL27791095 | 0.75 | ALOX15 (0.37) | — | |
| SCHEMBL8598544 | 0.73 | — | — | |
| SCHEMBL27921039 | 0.72 | GRIN2D (0.36) | — | |
| SCHEMBL28048813 | 0.71 | — | — | |
| SCHEMBL27523642 | 0.71 | GBA1 (0.33) | — | |
| SCHEMBL27772846 | 0.70 | CCR2 (0.32) | — | |
| SCHEMBL28257279 | 0.68 | GRIN2D (0.35) | — |
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 3 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 |
| CN-102574778-B | Novel biphenyl and phenyl-pyridine amides | HOFFMANN LA ROCHE | 2015-01-07 | — | — | CN | disclosed |