⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL333354 | 0.79 | — | — | |
| Morpholine SCHEMBL4649443 | 0.79 | GAA (0.39) | — | |
| Hydrochloric Acid SCHEMBL18154527 | 0.77 | — | — | |
| Ammonia Solution, Strong SCHEMBL28171435 | 0.77 | — | — | |
| SCHEMBL80643 | 0.74 | — | — | |
| SCHEMBL4198 | 0.74 | — | — | |
| SCHEMBL969300 | 0.74 | — | — | |
| SCHEMBL4621927 | 0.74 | FABP6 (0.35) | — | |
| Fluoride SCHEMBL27461973 | 0.74 | — | — | |
| SCHEMBL27620691 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7105547-B2 | Antimicrobial 1-aryl dihydropyridone compounds | PHARMACIA AND UPJOHN COMPANY (US) | 2006-09-12 | — | — | US | disclosed |
| US-20050070580-A1 | Antimicrobial 1-aryl dihydropyridone compounds | GORDEEV MIKHAIL FEDOR (US) | 2005-03-31 | — | — | US | disclosed |