⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6420523 | 0.80 | TSHR (0.36) | — | |
| SCHEMBL8387130 | 0.71 | — | — | |
| SCHEMBL8383167 | 0.71 | — | — | |
| SCHEMBL8384095 | 0.67 | — | — | |
| SCHEMBL8381726 | 0.63 | — | — | |
| SCHEMBL8380732 | 0.63 | — | — | |
| SCHEMBL863701 | 0.61 | — | — | |
| SCHEMBL523323 | 0.61 | — | — | |
| SCHEMBL2100489 | 0.59 | — | — | |
| SCHEMBL1828243 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6946537-B2 | Siloxane oligomers, a process for their production and their use | DEGUSSA AG (DE) | 2005-09-20 | — | — | US | disclosed |
| US-20040158090-A1 | Siloxane oligomers, a process for their production and their use | EVONIK DEGUSSA GMBH (DE) | 2004-08-12 | — | — | US | disclosed |
| US-20030018155-A1 | Siloxane oligomers, a process for their production and their use | DEGUSSA AG (DE) | 2003-01-23 | — | — | US | disclosed |