⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17373476 | 0.74 | — | — | |
| SCHEMBL7173595 | 0.72 | — | — | |
| SCHEMBL1140838 | 0.69 | — | — | |
| SCHEMBL27230622 | 0.68 | — | — | |
| SCHEMBL4810389 | 0.65 | — | — | |
| SCHEMBL17373477 | 0.63 | SHBG (0.35) | — | |
| SCHEMBL9540501 | 0.61 | — | — | |
| SCHEMBL144338 | 0.61 | — | — | |
| SCHEMBL536313 | 0.60 | — | — | |
| SCHEMBL5173876 | 0.60 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6841645-B1 | Peroxidised polyorganosiloxanes (POS), one of the methods for preparing them and their uses as bleaching agent in dental compositions | RHODIA CHIMIE (FR) | 2005-01-11 | — | — | US | disclosed |
| US-20050003995-A1 | Peroxide-comprising polyorganosiloxanes (POS), one of their processes of preparation and their uses, in particular as bleaching agent in dental compositions | DROMARD ADRIEN (FR) | 2005-01-06 | — | — | US | disclosed |
| US-6326061-B1 | CONTACTING TEXTILE MATERIAL WITH FORMULATION COMPRISING SILANE OR ORGANOSILOXANE HAVING MONOVALENT SIC-BONDED HYDROCARBON RADICAL HAVING PRIMARY, SECONDARY AND/OR TERTIARY AMINO GROUPS, AND ISO)OXYALKYL RADICAL ATTACHED TO SILOXANE | WACKER-CHEMIE GMBH (DE) | 2001-12-04 | — | — | US | disclosed |