⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6062693 | 0.93 | TSHR (0.37) | — | |
| SCHEMBL6063981 | 0.91 | TSHR (0.41) | — | |
| SCHEMBL6064295 | 0.91 | TSHR (0.41) | — | |
| SCHEMBL6063627 | 0.91 | TSHR (0.41) | — | |
| SCHEMBL389241 | 0.84 | — | — | |
| SCHEMBL705251 | 0.74 | — | — | |
| SCHEMBL706109 | 0.74 | — | — | |
| SCHEMBL22551459 | 0.72 | ALOX5 (0.39) | — | |
| SCHEMBL29104335 | 0.70 | — | — | |
| SCHEMBL6063306 | 0.70 | TSHR (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7015292-B2 | Silicon-containing olefin copolymer, crosslinkable rubber composition thereof, and use thereof | MITSUI CHEMICALS, INC. (JP) | 2006-03-21 | — | — | US | disclosed |
| US-20050038214-A1 | Silicon-containing olefin copolymer, crosslinkable rubber composition thereof, and use thereof | MITSUI CHEMICALS, INC. (JP) | 2005-02-17 | — | — | US | disclosed |