⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7064572 | 0.73 | — | — | |
| SCHEMBL10543871 | 0.69 | — | — | |
| SCHEMBL831645 | 0.69 | — | — | |
| SCHEMBL7396751 | 0.68 | — | — | |
| SCHEMBL8575230 | 0.68 | CYP3A4 (0.30) | — | |
| SCHEMBL10883726 | 0.65 | — | — | |
| SCHEMBL4487114 | 0.65 | — | — | |
| Butane SCHEMBL17061028 | 0.65 | — | — | |
| SCHEMBL11712450 | 0.65 | LAP3 (0.32) | — | |
| SCHEMBL6429406 | 0.64 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4138349-A | FOR LUBRICATING SOFT METALS SUCH AS COPPER OR BRONZE | GENERAL ELECTRIC COMPANY (US) | 1979-02-06 | — | — | US | claimed |
| 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 |
| US-20120064022-A1 | CYCLOSILOXANE-SUBSTITUTED POLYSILOXANE COMPOUNDS, COMPOSITIONS CONTAINING THE COMPOUNDS AND METHODS OF USE THEREOF | BIOFILM, INC. | 2012-03-15 | — | — | US | disclosed |
| US-4138349-A | FOR LUBRICATING SOFT METALS SUCH AS COPPER OR BRONZE | GENERAL ELECTRIC COMPANY (US) | 1979-02-06 | — | — | US | disclosed |