⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5755518 | 0.73 | — | — | |
| SCHEMBL3806101 | 0.66 | CYP19A1 (0.42) | — | |
| SCHEMBL6114432 | 0.65 | CA1 (0.38) | — | |
| SCHEMBL1147932 | 0.62 | — | — | |
| SCHEMBL27669704 | 0.62 | ALDH1A1 (0.32) | — | |
| SCHEMBL2842046 | 0.61 | — | — | |
| SCHEMBL11607583 | 0.60 | CA1 (0.35) | — | |
| SCHEMBL9593308 | 0.60 | NOTUM (0.30) | — | |
| SCHEMBL5873334 | 0.58 | — | — | |
| Water SCHEMBL14636839 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2571862-A1 | PRODRUG OF TRIAZOLONE COMPOUND | Eisai R&D Management Co., Ltd. (JP) | 2013-03-27 | — | — | EP | disclosed |
| WO-2011145747-A1 | PRODRUG OF TRIAZOLONE COMPOUND | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2011-11-24 | — | — | WO | disclosed |