⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31673150 | 0.96 | — | — | |
| SCHEMBL26279 | 0.96 | — | — | |
| SCHEMBL14476389 | 0.96 | — | — | |
| SCHEMBL11917825 | 0.96 | — | — | |
| Methane SCHEMBL23316999 | 0.92 | — | — | |
| Ammonia Solution, Strong SCHEMBL29099315 | 0.92 | — | — | |
| Methyl Alcohol SCHEMBL22770521 | 0.88 | — | — | |
| Propylene Oxide SCHEMBL11670469 | 0.88 | — | — | |
| Alcohol SCHEMBL14892059 | 0.79 | — | — | |
| Propene SCHEMBL11786006 | 0.79 | — | — |
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-115244109-A | Method for producing siloxane polymer | 东丽精细化工株式会社 | 2022-10-25 | — | — | CN | disclosed |
| US-5621038-A | CONTAINING A STERIC HINDERED ALKOXYLATED SILANE | OSI SPECIALTIES, INC. (US) | 1997-04-15 | — | — | US | disclosed |