⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3376276 | 0.65 | — | — | |
| SCHEMBL4362773 | 0.64 | — | — | |
| SCHEMBL7829463 | 0.59 | — | — | |
| SCHEMBL2554291 | 0.58 | — | — | |
| SCHEMBL6524195 | 0.57 | — | — | |
| SCHEMBL30378180 | 0.55 | — | — | |
| SCHEMBL1395061 | 0.53 | — | — | |
| SCHEMBL6519086 | 0.51 | — | — | |
| SCHEMBL4361182 | 0.51 | — | — | |
| Magnesium SCHEMBL12501204 | 0.49 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012011707-A2 | SUBSTITUTED PYRIDINONE DERIVATIVES AND METHODS FOR MANUFACTURING THE SAME | HYUNDAI PHARM CO., LTD. (KR) | 2012-01-26 | — | — | WO | disclosed |