⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28312353 | 0.97 | — | — | |
| SCHEMBL21724490 | 0.97 | — | — | |
| SCHEMBL28077508 | 0.82 | — | — | |
| SCHEMBL27389221 | 0.82 | — | — | |
| SCHEMBL14699193 | 0.80 | — | — | |
| SCHEMBL173993 | 0.80 | — | — | |
| SCHEMBL8937706 | 0.80 | — | — | |
| SCHEMBL867074 | 0.80 | — | — | |
| SCHEMBL29284719 | 0.80 | — | — | |
| SCHEMBL11281226 | 0.80 | — | — |
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-0768860-A2 | DENTAL IMPRESSION MATERIAL WITH CURE-INDICATING DYE | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1997-04-23 | — | — | EP | disclosed |
| WO-1996000560-A2 | DENTAL IMPRESSION MATERIAL WITH CURE-INDICATING DYE | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1996-01-11 | — | — | WO | disclosed |