⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL37811 | 0.91 | CYP1A2 (0.32) | — | |
| SCHEMBL37231 | 0.91 | CYP1A2 (0.32) | — | |
| SCHEMBL20136510 | 0.89 | CYP1A2 (0.31) | — | |
| Bromide SCHEMBL8028723 | 0.89 | DNM1 (0.35) | — | |
| Hydrochloric Acid SCHEMBL15330133 | 0.89 | DNM1 (0.35) | — | |
| SCHEMBL6686296 | 0.89 | CYP1A2 (0.31) | — | |
| SCHEMBL15022964 | 0.88 | — | — | |
| Ethylene SCHEMBL28805811 | 0.87 | CYP1A2 (0.30) | — | |
| SCHEMBL12898588 | 0.87 | — | — | |
| Alcohol SCHEMBL28827022 | 0.85 | CYP1A2 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1992005433-A1 | CONTINUOUS POSITIVE CHARGE CAPILLARY COLUMNS USED IN CAPILLARY ELECTROPHORESIS | KERR ROBERT (FR) | 1992-04-02 | — | — | WO | claimed |
| WO-2014043267-A1 | METHODS OF FABRICATING PHOTOACTIVE SUBSTRATES SUITABLE FOR ELECTROMAGNETIC TRANSMISSION AND FILTERING APPLICATIONS | LIFE BIOSCIENCE, INC. (US) | 2014-03-20 | — | — | WO | disclosed |
| WO-2011100445-A1 | METHODS TO FABRICATE A PHOTOACTIVE SUBSTRATE SUITABLE FOR MICROFABRICATION | LIFE BIOSCIENCE, INC. (US) | 2011-08-18 | — | — | WO | disclosed |
| CN-1735729-B | Composition for surface treatment of substrates | GE BAYER SILICONES GMBH & CO | 2010-05-26 | — | — | CN | disclosed |
| WO-2010011939-A2 | ASSAY PLATES, METHODS AND SYSTEMS HAVING ONE OR MORE ETCHED FEATURES | LIFE BIOSCIENCE, INC. (US) | 2010-01-28 | — | — | WO | disclosed |
| CN-1735729-A | Composition for surface treatment of substrates | GE BAYER SILICONES GMBH & CO (DE) | 2006-02-15 | — | — | CN | disclosed |