⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6934733 | 0.71 | — | — | |
| SCHEMBL31531926 | 0.67 | — | — | |
| SCHEMBL630934 | 0.63 | — | — | |
| SCHEMBL384345 | 0.63 | — | — | |
| SCHEMBL5907450 | 0.63 | — | — | |
| SCHEMBL189909 | 0.61 | — | — | |
| SCHEMBL31495018 | 0.59 | — | — | |
| SCHEMBL265947 | 0.57 | — | — | |
| SCHEMBL12857346 | 0.57 | — | — | |
| SCHEMBL15898028 | 0.57 | — | — |
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-6008309-A | CROSSLINKED ORGANOPOLYSILOXANE PARTICLES OF UNIFORM PARTICLE SIZE DISTRIBUTION HAVING CHEMICALLY BONDED METALS, SOLUBLE IN ORGANIC SOLVENTS SUCH AS METHYLENE CHLORIDE, PENTANE, ACETONE, ETHANOL AND WATER; USE IN CATALYST SYSTEMS | WACKER-CHEMIE GMBH (DE) | 1999-12-28 | — | — | US | disclosed |