⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3441102 | 0.79 | MGAM (0.69) | — | |
| SCHEMBL53913 | 0.79 | — | — | |
| SCHEMBL9449115 | 0.77 | — | — | |
| SCHEMBL1233928 | 0.77 | — | — | |
| Lithium SCHEMBL11306430 | 0.76 | MGAM (0.65) | — | |
| SCHEMBL11587161 | 0.76 | MGAM (0.65) | — | |
| SCHEMBL9461843 | 0.76 | MGAM (0.65) | — | |
| SCHEMBL708003 | 0.76 | MGAM (0.65) | — | |
| Hydrochloric Acid SCHEMBL5097295 | 0.76 | MGAM (0.65) | — | |
| SCHEMBL4776595 | 0.76 | MGAM (0.65) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2789338-A2 | Condensed pyridine derivate and use thereof | Takeda Pharmaceutical Company Limited (JP) | 2014-10-15 | — | — | EP | disclosed |
| US-20100266504-A1 | CONDENSED PYRIDINE DERIVATIVE AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-10-21 | — | — | US | disclosed |
| EP-2216023-A1 | CONDENSED PYRIDINE DERIVATIVE AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2010-08-11 | — | — | EP | disclosed |