⚠ 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 | |
|---|---|---|---|---|
| Methylsulfanylmethane SCHEMBL27673289 | 0.84 | — | — | |
| Cyanate SCHEMBL28106963 | 0.82 | — | — | |
| Cyanate SCHEMBL8717839 | 0.78 | — | — | |
| Cyanate SCHEMBL27880535 | 0.78 | — | — | |
| Cyanate SCHEMBL19371516 | 0.78 | — | — | |
| Cyanate SCHEMBL9247034 | 0.78 | CA1 (1.00) | — | |
| Cyanate SCHEMBL11311543 | 0.78 | — | — | |
| Cyanate SCHEMBL476210 | 0.78 | — | — | |
| Cyanate SCHEMBL3699783 | 0.78 | — | — | |
| Cyanate SCHEMBL19680 | 0.78 | — | — |
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-101228206-B | Sulfur-containing cycloolefin resin and process for producing the same | TOSOH CORP | 2010-12-01 | — | — | CN | disclosed |
| CN-101228206-A | Sulfur-containing cycloolefin resin and process for producing the same | TOSOH CORP (JP) | 2008-07-23 | — | — | CN | disclosed |