⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL133585 | 0.73 | TSHR (0.32) | — | |
| SCHEMBL465459 | 0.72 | — | — | |
| SCHEMBL165067 | 0.70 | — | — | |
| SCHEMBL556623 | 0.67 | — | — | |
| SCHEMBL11740791 | 0.67 | — | — | |
| SCHEMBL3725565 | 0.65 | — | — | |
| SCHEMBL10443274 | 0.65 | — | — | |
| SCHEMBL29188270 | 0.65 | — | — | |
| SCHEMBL28929802 | 0.65 | — | — | |
| SCHEMBL5319801 | 0.65 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9074032-B2 | Membranes based on polyvinyl alcohol | WACKER CHEMIE AG (DE) | 2015-07-07 | — | — | US | disclosed |
| EP-2235091-B1 | METHOD FOR PRODUCING ISOCYANATE-TERMINATED SILOXANES | WACKER CHEMIE AG (DE) | 2012-11-07 | — | — | EP | disclosed |
| US-8304569-B2 | Method for producing isocyanate-terminated siloxanes | WACKER CHEMIE AG (DE) | 2012-11-06 | — | — | US | disclosed |
| US-20120031843-A1 | Membranes based on polyvinyl alcohol | WACKER CHEMIE AG (DE) | 2012-02-09 | — | — | US | disclosed |
| US-20100286426-A1 | METHOD FOR PRODUCING ISOCYANATE-TERMINATED SILOXANES | WACKER CHEMIE AG (DE) | 2010-11-11 | — | — | US | disclosed |
| WO-2010119004-A1 | COMPOSITION BASED ON SILOXANE COPOLYMERS | WACKER CHEMIE AG (DE) | 2010-10-21 | — | — | WO | disclosed |
| EP-2104611-B1 | LAMINATES COMPRISING THERMOPLASTIC POLYSILOXANE UREA COPOLYMERS | WACKER CHEMIE AG (DE) | 2010-05-12 | — | — | EP | disclosed |
| US-20100047589-A1 | LAMINATES COMPRISING THERMOPLASTIC POLYSILOXANE-UREA COPOLYMERS | WACKER CHEMIE AG (DE) | 2010-02-25 | — | — | US | disclosed |
| US-20060204765-A1 | Laminated glass with polysiloxane-urea copolymer | WACKER-CHEMIE GMBH (DE) | 2006-09-14 | — | — | US | disclosed |