⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15609636 | 0.83 | TSHR (0.41) | — | |
| SCHEMBL1978462 | 0.80 | — | — | |
| SCHEMBL15474419 | 0.77 | TSHR (0.33) | — | |
| SCHEMBL3680416 | 0.75 | — | — | |
| SCHEMBL15609726 | 0.74 | — | — | |
| SCHEMBL1182208 | 0.73 | — | — | |
| SCHEMBL20912513 | 0.72 | — | — | |
| SCHEMBL20912525 | 0.72 | — | — | |
| SCHEMBL20912527 | 0.72 | — | — | |
| SCHEMBL20912523 | 0.72 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110077365-A1 | PREPARATION OF ORGANOSILICON-CONTAINING TRIAZOLES | MCMASTER UNIVERSITY (CA) | 2011-03-31 | — | — | US | disclosed |
| EP-0320537-B1 | A VINYL POLYMER CONTAINING SILICONS AND PREPARATION THEREOF | Nippon Paint Co., Ltd. (JP) | 1993-08-04 | — | — | EP | disclosed |
| US-4980442-A | Vinyl polymer containing silicons and preparation thereof | NIPPON PAINT CO., LTD. (JP) | 1990-12-25 | — | — | US | disclosed |
| US-4888406-A | PROTECTIVE COATINGS | NIPPON PAINT CO., LTD. (JP) | 1989-12-19 | — | — | US | disclosed |
| EP-0320537-A1 | A vinyl polymer containing silicons and preparation thereof | Nippon Paint Co., Ltd. (JP) | 1989-06-21 | — | — | EP | disclosed |