⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30299 | 1.00 | — | — | |
| SCHEMBL109472 | 0.84 | — | — | |
| SCHEMBL133254 | 0.83 | — | — | |
| SCHEMBL890939 | 0.81 | — | — | |
| SCHEMBL1228631 | 0.80 | — | — | |
| SCHEMBL11401759 | 0.79 | — | — | |
| SCHEMBL11402355 | 0.79 | NAAA (0.31) | — | |
| SCHEMBL11213746 | 0.75 | — | — | |
| SCHEMBL11209665 | 0.74 | — | — | |
| SCHEMBL109474 | 0.73 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3064519-B1 | Aqueous polyurethane urea dispersion containing free acid groups | COVESTRO DEUTSCHLAND AG (DE) | 2018-12-19 | — | — | EP | disclosed |
| EP-3064519-A1 | Aqueous polyurethane urea dispersion containing free acid groups | Covestro Deutschland AG (DE) | 2016-09-07 | — | — | EP | disclosed |
| EP-2398835-B1 | FUNCTIONALIZED POLYURETHANE POLYUREA DISPERSIONS | BAYER MATERIALSCIENCE AG (DE) | 2012-12-19 | — | — | EP | disclosed |
| WO-2012020026-A1 | PROCESS FOR THE PRODUCTION OF POLYURETHANE-UREA DISPERSIONS | BAYER MATERIALSCIENCE AG (DE) | 2012-02-16 | — | — | WO | disclosed |
| EP-2209828-B1 | NON-IONIC HYDROPHILIZED BINDER DISPERSIONS | BAYER MATERIALSCIENCE AG (DE) | 2011-08-03 | — | — | EP | disclosed |
| EP-2221330-A1 | Functionalised polyurethane polyuric dispersions | Bayer MaterialScience AG (DE) | 2010-08-25 | — | — | EP | disclosed |
| EP-2209828-A1 | NON-IONIC HYDROPHILIZED BINDER DISPERSIONS | Bayer MaterialScience AG (DE) | 2010-07-28 | — | — | EP | disclosed |
| WO-2009062603-A1 | NON-IONIC HYDROPHILIZED BINDER DISPERSIONS | BAYER MATERIALSCIENCE AG (DE) | 2009-05-22 | — | — | WO | disclosed |
| EP-1999172-A1 | AQUEOUS DISPERSIONS BASED ON NITROCELLULOSE-POLYURETHANE PARTICLES | Bayer MaterialScience AG (DE) | 2008-12-10 | — | — | EP | disclosed |
| US-20080081870-A1 | Size composition | BAYER MATERIALSCIENCE AG (DE) | 2008-04-03 | — | — | US | disclosed |
| EP-1905788-A2 | Sizing composition | Bayer MaterialScience AG (DE) | 2008-04-02 | — | — | EP | disclosed |
| WO-2007107232-A1 | AQUEOUS DISPERSIONS BASED ON NITROCELLULOSE-POLYURETHANE PARTICLES | BAYER MATERIALSCIENCE AG (DE) | 2007-09-27 | — | — | WO | disclosed |