⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8508545 | 1.00 | — | — | |
| SCHEMBL17298149 | 0.86 | ALDH1A1 (0.30) | — | |
| SCHEMBL5552365 | 0.83 | — | — | |
| SCHEMBL8509978 | 0.81 | TSHR (0.30) | — | |
| SCHEMBL8509985 | 0.81 | TSHR (0.30) | — | |
| SCHEMBL8721998 | 0.81 | TSHR (0.30) | — | |
| SCHEMBL8511701 | 0.79 | — | — | |
| SCHEMBL8509240 | 0.79 | — | — | |
| SCHEMBL16943606 | 0.79 | — | — | |
| SCHEMBL10539668 | 0.77 | TSHR (0.43) | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0612756-B1 | Organosilicon compounds | NIPPON TELEGRAPH & TELEPHONE (JP) | 1999-04-28 | — | — | EP | claimed |
| CN-106176250-B | Tooth adhesive system based on new hydrophobic adhesion concept | 浙江大学 | 2020-06-23 | — | — | CN | disclosed |
| CN-106176250-A | Tooth bonding agent system based on hydrophobic bonding new concept | 浙江大学 | 2016-12-07 | — | — | CN | disclosed |
| EP-1668018-B9 | PREPARATION OF A HALOSILYLATED CHAIN HYDROCARBON | DOW CORNING TORAY CO LTD (JP) | 2009-01-07 | — | — | EP | disclosed |
| US-7456307-B2 | Preparation of a halosilylated chain hydrocarbon | DOW CORNING TORAY COMPANY, LTD. (JP) | 2008-11-25 | — | — | US | disclosed |
| EP-1668018-B1 | PREPARATION OF A HALOSILYLATED CHAIN HYDROCARBON | DOW CORNING TORAY CO LTD (JP) | 2007-11-28 | — | — | EP | disclosed |
| US-20070055074-A1 | Preparation of a halosilylated chain hydrocarbon | DOW CORNING TORAY COMPANY, LTD. (JP) | 2007-03-08 | — | — | US | disclosed |
| EP-1668018-A1 | PREPARATION OF A HALOSILYLATED CHAIN HYDROCARBON | Dow Corning Toray Co., Ltd. (JP) | 2006-06-14 | — | — | EP | disclosed |
| WO-2005033116-A1 | PREPARATION OF A HALOSILYLATED CHAIN HYDROCARBON | DOW CORNING TORAY CO., LTD. (JP) | 2005-04-14 | — | — | WO | disclosed |
| EP-0612756-B1 | Organosilicon compounds | NIPPON TELEGRAPH & TELEPHONE (JP) | 1999-04-28 | — | — | EP | disclosed |
| US-5710301-A | Organosilicon compounds | NIPPON TELEGRAPH & TELEPHONE CORPORATION (JP) | 1998-01-20 | — | — | US | disclosed |
| EP-0612756-A1 | Organosilicon compounds | NIPPON TELEGRAPH AND TELEPHONE CORPORATION (JP) | 1994-08-31 | — | — | EP | disclosed |