⚠ 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL2475575 | 0.94 | — | — | |
| Water SCHEMBL5058127 | 0.94 | — | — | |
| SCHEMBL54725 | 0.93 | — | — | |
| SCHEMBL223365 | 0.93 | — | — | |
| SCHEMBL28870280 | 0.93 | — | — | |
| SCHEMBL57266 | 0.93 | — | — | |
| SCHEMBL25245787 | 0.86 | — | — | |
| SCHEMBL2472593 | 0.86 | — | — | |
| SCHEMBL11422369 | 0.86 | — | — | |
| SCHEMBL15738465 | 0.86 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110520480-A | Silicone rubber composite foam material | ELKEM SILICONES USA CORP | 2019-11-29 | — | — | CN | disclosed |
| CN-110462875-A | SECONDARY BATTERY PACK WITH IMPROVED THERMAL MANAGEMENT | ELKEM SILICONES USA CORP | 2019-11-15 | — | — | CN | disclosed |