⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL784060 | 0.87 | — | — | |
| SCHEMBL3370957 | 0.87 | — | — | |
| SCHEMBL8629754 | 0.87 | — | — | |
| SCHEMBL144868 | 0.87 | — | — | |
| SCHEMBL640748 | 0.87 | — | — | |
| SCHEMBL28222294 | 0.87 | — | — | |
| SCHEMBL11624191 | 0.87 | — | — | |
| SCHEMBL5407167 | 0.75 | — | — | |
| SCHEMBL14891947 | 0.75 | — | — | |
| SCHEMBL926745 | 0.75 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20040007296-A1 | Casting of single crystal superalloy articles with reduced eutectic scale and grain recrystallization | HOWMET RESEARCH CORPORATION | 2004-01-15 | — | — | US | disclosed |
| US-20020007877-A1 | CASTING OF SINGLE CRYSTAL SUPERALLOY ARTICLES WITH REDUCED EUTECTIC SCALE AND GRAIN RECRYSTALLIZATION | HOWMET RESEARCH CORPORATION | 2002-01-24 | — | — | US | disclosed |
| EP-1038983-A1 | Single crystal nickel-base alloy | Howmet Research Corporation (US) | 2000-09-27 | — | — | EP | disclosed |