⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6064493 | 0.78 | — | — | |
| SCHEMBL6063680 | 0.74 | TSHR (0.33) | — | |
| SCHEMBL30678929 | 0.71 | — | — | |
| SCHEMBL10938428 | 0.71 | — | — | |
| SCHEMBL9506612 | 0.69 | NR1H2 (0.31) | — | |
| SCHEMBL235670 | 0.67 | — | — | |
| SCHEMBL123281 | 0.67 | — | — | |
| SCHEMBL116908 | 0.67 | — | — | |
| SCHEMBL16477673 | 0.67 | ALOX5 (0.32) | — | |
| SCHEMBL168085 | 0.65 | — | — |
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 |