⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30131 | 0.96 | — | — | |
| SCHEMBL2921014 | 0.71 | — | — | |
| SCHEMBL13844090 | 0.71 | — | — | |
| SCHEMBL11331983 | 0.71 | — | — | |
| SCHEMBL1765860 | 0.64 | — | — | |
| SCHEMBL350731 | 0.64 | — | — | |
| SCHEMBL10828751 | 0.64 | — | — | |
| SCHEMBL322276 | 0.64 | — | — | |
| SCHEMBL793680 | 0.64 | — | — | |
| SCHEMBL8825951 | 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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2002542064-A | — | — | 2002-12-10 | — | — | JP | claimed |
| JP-2002542320-A | — | — | 2002-12-10 | — | — | JP | claimed |
| US-20020028877-A1 | Polyurethane films and dispersions for the preparation thereof | PARKS FRANKLIN E (US) | 2002-03-07 | — | — | US | claimed |
| EP-1173494-A1 | POLYURETHANE FILMS PREPARED BY ELECTRODEPOSITION FROM POLYURETHANE DISPERSIONS | THE DOW CHEMICAL COMPANY (US) | 2002-01-23 | — | — | EP | claimed |
| EP-1173492-A1 | POLYURETHANE FILMS AND DISPERSIONS FOR THE PREPARATION THEREOF | THE DOW CHEMICAL COMPANY (US) | 2002-01-23 | — | — | EP | claimed |
| WO-2000061652-A1 | POLYURETHANE FILMS PREPARED BY ELECTRODEPOSITION FROM POLYURETHANE DISPERSIONS | THE DOW CHEMICAL COMPANY (US) | 2000-10-19 | — | — | WO | claimed |
| WO-2000061651-A1 | POLYURETHANE FILMS AND DISPERSIONS FOR THE PREPARATION THEREOF | THE DOW CHEMICAL COMPANY (US) | 2000-10-19 | — | — | WO | claimed |
| EP-1367072-B1 | Polyurethane/ureas useful for the production of spandex and a process for their production | BAYER CORP (US) | 2008-06-25 | — | — | EP | disclosed |
| EP-1367072-A1 | Polyurethane/ureas useful for the production of spandex and a process for their production | Bayer Corporation (US) | 2003-12-03 | — | — | EP | disclosed |
| US-6624281-B1 | Chain extending isocyanate-terminated polyoxypropylene glycol or polyoxytetramethylene glycol prepolymer; condensation copolymerization | BAYER CORPORATION | 2003-09-23 | — | — | US | disclosed |