⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4592313 | 1.00 | — | — | |
| SCHEMBL5599647 | 1.00 | — | — | |
| SCHEMBL29288134 | 0.94 | PRCP (0.44) | — | |
| SCHEMBL19815952 | 0.94 | PRCP (0.44) | — | |
| SCHEMBL5970059 | 0.84 | PRCP (0.44) | — | |
| SCHEMBL5794043 | 0.82 | PRCP (0.51) | — | |
| SCHEMBL17375664 | 0.82 | PRCP (0.51) | — | |
| SCHEMBL17375666 | 0.82 | PRCP (0.51) | — | |
| SCHEMBL5371415 | 0.81 | GLI1 (0.64) | — | |
| SCHEMBL443064 | 0.80 | — | — |
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-3517536-B1 | AMINOTRIAZINE DERIVATIVES USEFUL AS TANK-BINDING KINASE INHIBITOR COMPOUNDS | GILEAD SCIENCES INC (US) | 2021-05-05 | — | — | EP | disclosed |
| WO-2007009299-A1 | OPTICALLY PURE N',N'-DI SUBSTITUTED -PROLYLHYDRAZINES AS WELL AS THE PREPARATION AND USE THEREOF | CHENGDU INSTITUTE OF BIOLOGY, CHINESE ACADEMY OF SCIENCES (CN) | 2007-01-25 | — | — | WO | disclosed |