⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL253187 | 0.74 | — | — | |
| SCHEMBL4256869 | 0.70 | — | — | |
| SCHEMBL4258889 | 0.65 | — | — | |
| SCHEMBL327250 | 0.62 | — | — | |
| SCHEMBL4563944 | 0.61 | — | — | |
| SCHEMBL10771174 | 0.60 | — | — | |
| SCHEMBL11764366 | 0.58 | — | — | |
| SCHEMBL11036078 | 0.58 | — | — | |
| SCHEMBL9241486 | 0.58 | — | — | |
| SCHEMBL5014859 | 0.58 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1117727-B1 | ORGANOSILOXANE CONTAINING MODIFIED GROUPS IN PESTICIDAL COMPOSTIONS | GEN ELECTRIC (US) | 2004-07-07 | — | — | EP | disclosed |
| EP-1117727-A1 | ORGANOSILOXANE CONTAINING MODIFIED GROUPS IN PESTICIDAL COMPOSTIONS | Crompton Corporation (US) | 2001-07-25 | — | — | EP | disclosed |
| WO-2000018825-A1 | ORGANOSILOXANE CONTAINING MODIFIED GROUPS IN PESTICIDAL COMPOSTIONS | CROMPTON CORPORATION (US) | 2000-04-06 | — | — | WO | disclosed |