⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6192014 | 1.00 | — | — | |
| SCHEMBL31425758 | 0.67 | — | — | |
| SCHEMBL4940647 | 0.62 | — | — | |
| SCHEMBL28229242 | 0.62 | — | — | |
| SCHEMBL797535 | 0.62 | — | — | |
| SCHEMBL11790920 | 0.62 | — | — | |
| Hydrochloric Acid SCHEMBL27759944 | 0.61 | — | — | |
| SCHEMBL10544280 | 0.61 | — | — | |
| SCHEMBL31070899 | 0.61 | — | — | |
| SCHEMBL27553208 | 0.61 | — | — |
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-1513844-A1 | NOVEL INTERLEUKIN-1 BETA CONVERTING ENZYME INHIBITORS | THE PROCTER & GAMBLE COMPANY (US) | 2005-03-16 | — | — | EP | disclosed |
| WO-2003106460-A1 | NOVEL INTERLEUKIN-1 BETA CONVERTING ENZYME INHIBITORS | THE PROCTER & GAMBLE COMPANY (US) | 2003-12-24 | — | — | WO | disclosed |