⚠ 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 | |
|---|---|---|---|---|
| N,N-Dimethylethanaminium SCHEMBL4263209 | 0.83 | — | — | |
| Bromoethane SCHEMBL28057606 | 0.79 | — | — | |
| Methoxymethane SCHEMBL27447998 | 0.78 | ALDH1A1 (0.35) | — | |
| SCHEMBL467744 | 0.78 | — | — | |
| Butane SCHEMBL374533 | 0.74 | — | — | |
| N-Propyl Bromide SCHEMBL27825886 | 0.73 | — | — | |
| SCHEMBL22634 | 0.73 | — | — | |
| SCHEMBL124190 | 0.73 | — | — | |
| SCHEMBL30 | 0.73 | — | — | |
| SCHEMBL8619869 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8197591-B2 | Pearlescent pigments having a secondary coating comprising α-silanes and method for the production thereof | ECKART GMBH (DE) | 2012-06-12 | — | — | US | disclosed |
| US-20090249979-A1 | PEARLESCENT PIGMENTS HAVING A SECONDARY COATING COMPRISING ALPHA-SILANES AND METHOD FOR THE PRODUCTION THEREOF | ECKART GMBH (DE) | 2009-10-08 | — | — | US | disclosed |
| US-7491786-B2 | Crosslinkable compositions based on organosilicon compounds | WACKER CHEMIE AG (DE) | 2009-02-17 | — | — | US | disclosed |
| US-20050215747-A1 | Crosslinkable compositions based on organosilicon compounds | WACKER-CHEMIE GMBH (DE) | 2005-09-29 | — | — | US | disclosed |