⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18354 | 1.00 | — | — | |
| SCHEMBL28497 | 1.00 | — | — | |
| SCHEMBL6832751 | 1.00 | — | — | |
| SCHEMBL5960086 | 0.94 | — | — | |
| SCHEMBL5960085 | 0.94 | — | — | |
| SCHEMBL7137573 | 0.94 | — | — | |
| SCHEMBL20678779 | 0.94 | — | — | |
| SCHEMBL21747500 | 0.94 | — | — | |
| SCHEMBL15676686 | 0.78 | — | — | |
| SCHEMBL682112 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5914420-A | UNSTRAINED POLYMERIZABLE CYCLOSILOXANES HAVING A SUBSTITUENT THAT CONTAINS A PERFLUORINATED ORGANIC MOIETY | PCR, INC. (US) | 1999-06-22 | — | — | US | disclosed |
| US-5892086-A | Perfluorinated ether organo substituted cyclosiloxanes and copolymers prepared from these cyclosiloxanes | PCR, INC. (US) | 1999-04-06 | — | — | US | disclosed |