⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8238167 | 0.66 | KDM4E (0.40) | — | |
| SCHEMBL10534630 | 0.65 | — | — | |
| SCHEMBL308340 | 0.65 | — | — | |
| SCHEMBL9594801 | 0.65 | — | — | |
| SCHEMBL79940 | 0.64 | — | — | |
| SCHEMBL27363958 | 0.61 | KIF11 (0.35) | — | |
| SCHEMBL634396 | 0.60 | HDAC8 (0.45) | — | |
| SCHEMBL3361203 | 0.60 | NOTUM (0.44) | — | |
| SCHEMBL14867 | 0.57 | — | — | |
| SCHEMBL28222778 | 0.57 | ALDH1A1 (0.59) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6833346-B1 | Easily attaining uniform dosage of all active ingredients; adhering to base particles | THE PROCTER & GAMBLE COMPANY | 2004-12-21 | — | — | US | disclosed |