⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10336980 | 0.85 | — | — | |
| SCHEMBL8523778 | 0.74 | — | — | |
| SCHEMBL268640 | 0.74 | — | — | |
| SCHEMBL525803 | 0.72 | — | — | |
| SCHEMBL1772372 | 0.72 | — | — | |
| SCHEMBL1396032 | 0.71 | — | — | |
| Ammonia Solution, Strong SCHEMBL12502446 | 0.71 | — | — | |
| SCHEMBL12502284 | 0.71 | — | — | |
| SCHEMBL21174915 | 0.71 | — | — | |
| SCHEMBL7743012 | 0.71 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9175141-B2 | Cyclosiloxane-substituted polysiloxane compounds, compositions containing the compounds and methods of use thereof | BIOFILM IP, LLC (US) | 2015-11-03 | — | — | US | disclosed |
| EP-2601245-A1 | CYCLOSILOXANE-SUBSTITUTED POLYSILOXANE COMPOUNDS, COMPOSITIONS CONTAINING THE COMPOUNDS AND METHODS OF USE THEREOF | Biofilm IP, LLC (US) | 2013-06-12 | — | — | EP | disclosed |
| CN-103154095-A | Cyclosiloxane-substituted polysiloxane compounds, compositions containing the same, and methods of use thereof | BIOFILM IP LLC | 2013-06-12 | — | — | CN | disclosed |
| US-20120064022-A1 | CYCLOSILOXANE-SUBSTITUTED POLYSILOXANE COMPOUNDS, COMPOSITIONS CONTAINING THE COMPOUNDS AND METHODS OF USE THEREOF | BIOFILM, INC. | 2012-03-15 | — | — | US | disclosed |
| WO-2012018403-A1 | CYCLOSILOXANE-SUBSTITUTED POLYSILOXANE COMPOUNDS, COMPOSITIONS CONTAINING THE COMPOUNDS AND METHODS OF USE THEREOF | BIOFILM IP, LLC (US) | 2012-02-09 | — | — | WO | disclosed |
| US-5464917-A | Organopolysiloxane | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1995-11-07 | — | — | US | disclosed |