⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5435741 | 0.80 | THRB (0.33) | — | |
| SCHEMBL15255204 | 0.80 | — | — | |
| SCHEMBL28430360 | 0.78 | TSHR (0.30) | — | |
| SCHEMBL3896453 | 0.77 | — | — | |
| SCHEMBL6703077 | 0.76 | — | — | |
| SCHEMBL28773750 | 0.75 | — | — | |
| SCHEMBL1142640 | 0.75 | — | — | |
| SCHEMBL3890498 | 0.74 | — | — | |
| SCHEMBL963718 | 0.73 | TSHR (0.34) | — | |
| SCHEMBL15015670 | 0.73 | ENPEP (0.31) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1099703-B1 | Process for preparing alkoxysilanes | DEGUSSA (DE) | 2004-08-11 | — | — | EP | disclosed |
| EP-0997468-B1 | Process for neutralising or reducing chlorine content of alkoxy silanes or alkoxysilane-based compositions | DEGUSSA (DE) | 2004-01-21 | — | — | EP | disclosed |
| EP-1099703-A2 | Process for preparing alkoxysilanes | Degussa AG (DE) | 2001-05-16 | — | — | EP | disclosed |
| US-6177584-B1 | Process for neutralizing and reducing residual halogen contents in alkoxysilanes or alkoxysilane-based compositions | DEGUSSA-HUELS AKTIENGESELLSCHAFT (DE) | 2001-01-23 | — | — | US | disclosed |
| EP-0997468-A2 | Process for neutralising or reducing chlorine content of alkoxy silanes or alkoxysilane-based compositions | Degussa-Hüls Aktiengesellschaft (DE) | 2000-05-03 | — | — | EP | disclosed |