⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12853821 | 0.80 | ALOX5 (0.46) | — | |
| SCHEMBL27393154 | 0.76 | ACHE (0.47) | — | |
| SCHEMBL29953793 | 0.74 | ALOX5 (0.45) | — | |
| SCHEMBL12853946 | 0.74 | ALOX5 (0.53) | — | |
| SCHEMBL12313359 | 0.73 | ALOX5 (0.51) | — | |
| SCHEMBL6297735 | 0.73 | ALOX5 (0.44) | — | |
| SCHEMBL13206923 | 0.73 | SIGMAR1 (0.53) | — | |
| SCHEMBL152864 | 0.72 | — | — | |
| SCHEMBL29952316 | 0.72 | ALOX5 (0.42) | — | |
| SCHEMBL12265807 | 0.72 | ALOX5 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016176449-A1 | BENZIMIDAZOLONE AND BENZOTHIAZOLONE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2016-11-03 | — | — | WO | disclosed |
| US-5373000-A | Antibacterial agent against both grampositive and gramnegative bacterias | EISAI CO., LTD. (JP) | 1994-12-13 | — | — | US | disclosed |
| EP-0329785-B1 | CEPHALOSPORIN DERIVATIVES | EISAI CO LTD (JP) | 1994-11-30 | — | — | EP | disclosed |
| EP-0329785-A1 | CEPHALOSPORIN DERIVATIVES | Eisai Co., Ltd. (JP) | 1989-08-30 | — | — | EP | disclosed |