⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5650143 | 0.92 | ESR1 (0.31) | — | |
| SCHEMBL20912531 | 0.85 | — | — | |
| SCHEMBL20912526 | 0.85 | — | — | |
| SCHEMBL28490406 | 0.85 | — | — | |
| SCHEMBL5647074 | 0.84 | ESR1 (0.33) | — | |
| SCHEMBL12680906 | 0.84 | — | — | |
| SCHEMBL12680910 | 0.80 | — | — | |
| SCHEMBL12680908 | 0.79 | — | — | |
| SCHEMBL15830982 | 0.79 | — | — | |
| SCHEMBL14870533 | 0.78 | — | — |
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-6956087-B2 | High refractive index polysiloxane prepolymers | BAUSCH & LOMB INCORPORATED (US) | 2005-10-18 | — | — | US | disclosed |
| US-20050176898-A1 | High refractive index polysiloxane prepolymers | BAUSCH & LOMB INCORPORATED | 2005-08-11 | — | — | US | disclosed |
| US-20040116593-A1 | High refractive index polysiloxane prepolymers | SOLTA MEDICAL IRELAND LIMITED (IE) | 2004-06-17 | — | — | US | disclosed |