⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9386993 | 0.84 | CYP2C19 (0.45) | — | |
| SCHEMBL5616281 | 0.83 | MAPT (0.38) | — | |
| SCHEMBL2058061 | 0.82 | — | — | |
| SCHEMBL40907 | 0.79 | — | — | |
| SCHEMBL3052525 | 0.78 | CYP2C19 (0.32) | — | |
| SCHEMBL12866023 | 0.77 | TSHR (0.43) | — | |
| SCHEMBL17571077 | 0.76 | CYP2C19 (0.31) | — | |
| SCHEMBL28932451 | 0.75 | CYP2C19 (0.38) | — | |
| SCHEMBL14985825 | 0.75 | CYP2C19 (0.43) | — | |
| SCHEMBL8347657 | 0.75 | PRMT1 (0.48) | — |
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-3252041-A1 | BIPYRIDINE COMPOUND AND USE OF SAME FOR NOXIOUS ARTHROPOD CONTROL | Sumitomo Chemical Company, Limited (JP) | 2017-12-06 | — | — | EP | disclosed |
| EP-2924053-A1 | GLYCOSYLATED LINKER, COMPOUND CONTAINING GLYCOSYLATED LINKER MOIETY AND PHYSIOLOGICALLY ACTIVE SUBSTANCE MOIETY OR SALT THEREOF, AND METHODS FOR PRODUCING SAID COMPOUND OR SALT THEREOF | Glytech, Inc. (JP) | 2015-09-30 | — | — | EP | disclosed |