⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL142952 | 0.73 | OPRM1 (0.33) | — | |
| SCHEMBL3639487 | 0.73 | OPRM1 (0.33) | — | |
| SCHEMBL394788 | 0.71 | — | — | |
| Bromide SCHEMBL8028722 | 0.71 | OPRM1 (0.32) | — | |
| SCHEMBL2827730 | 0.70 | OPRM1 (0.41) | — | |
| SCHEMBL28192641 | 0.69 | — | — | |
| SCHEMBL11658167 | 0.69 | ALDH1A1 (0.36) | — | |
| SCHEMBL10624899 | 0.69 | ALDH1A1 (0.36) | — | |
| SCHEMBL11662261 | 0.69 | ALDH1A1 (0.36) | — | |
| SCHEMBL2927189 | 0.68 | OPRM1 (0.50) | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8772421-B2 | Polymers with improved strength comprising mixed oxyalkyl units | HENKEL AG & CO. KGAA (DE) | 2014-07-08 | — | — | US | disclosed |
| EP-1668090-B1 | COHESION-REDUCED BINDER PRODUCTION AND USE THEREOF IN DETACHABLE ASSEMBLY ADHESIVES | HENKEL AG & CO KGAA (DE) | 2010-09-08 | — | — | EP | disclosed |
| EP-1678254-B1 | POLYMERS WITH IMPROVED STRENGTH COMPRISING MIXED OXYALKYL UNITS | HENKEL KGAA (DE) | 2007-05-09 | — | — | EP | disclosed |
| US-20060247407-A1 | Polymers with urea groups and silyl groups and production and use thereof | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) | 2006-11-02 | — | — | US | disclosed |
| US-20060194930-A1 | Polymers with improved strength comprising mixed oxyalkyl units | HENKEL AG & CO. KGAA (DE) | 2006-08-31 | — | — | US | disclosed |
| US-20060178470-A1 | Cohesion-reduced binder production and use thereof in detachable assembly adhesives | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) | 2006-08-10 | — | — | US | disclosed |
| EP-1685175-A1 | POLYURETHANE COMPOSITIONS WITH NCO AND SILYL REACTIVITY | Henkel Kommanditgesellschaft auf Aktien (DE) | 2006-08-02 | — | — | EP | disclosed |
| EP-1678254-A1 | POLYMERS WITH IMPROVED STRENGTH COMPRISING MIXED OXYALKYL UNITS | Henkel Kommanditgesellschaft auf Aktien (DE) | 2006-07-12 | — | — | EP | disclosed |
| EP-1668090-A1 | COHESION-REDUCED BINDER PRODUCTION AND USE THEREOF IN DETACHABLE ASSEMBLY ADHESIVES | Henkel Kommanditgesellschaft auf Aktien (DE) | 2006-06-14 | — | — | EP | disclosed |
| US-7057001-B2 | Polymers with urea groups and silyl groups and production and use thereof | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) | 2006-06-06 | — | — | US | disclosed |
| US-20050260401-A1 | Polymers with urea groups and silyl groups and production and use thereof | HENKEL AG & CO. KGAA (DE) | 2005-11-24 | — | — | US | disclosed |
| WO-2005049684-A1 | POLYURETHANE COMPOSITIONS WITH NCO AND SILYL REACTIVITY | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2005-06-02 | — | — | WO | disclosed |
| WO-2005047394-A1 | POLYMERS WITH IMPROVED STRENGTH COMPRISING MIXED OXYALKYL UNITS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2005-05-26 | — | — | WO | disclosed |
| WO-2005044888-A1 | STEAM-BLOCKING POLYURETHANE AND ADHESIVE MOULDED BODY PRODUCED THEREFROM | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2005-05-19 | — | — | WO | disclosed |
| WO-2005042610-A2 | STORAGE-STABLE POLYURETHANE COMPRISING SILYL GROUPS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2005-05-12 | — | — | WO | disclosed |
| WO-2005033241-A1 | COHESION-REDUCED BINDER PRODUCTION AND USE THEREOF IN DETACHABLE ASSEMBLY ADHESIVES | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2005-04-14 | — | — | WO | disclosed |
| EP-1328586-A1 | POLYMERS WITH UREA GROUPS AND SILYL GROUPS AND PRODUCTION AND USE THEREOF | Henkel Kommanditgesellschaft auf Aktien (DE) | 2003-07-23 | — | — | EP | disclosed |
| WO-2002034838-A1 | POLYMERS WITH UREA GROUPS AND SILYL GROUPS AND PRODUCTION AND USE THEREOF | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2002-05-02 | — | — | WO | disclosed |