⚠ 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 | |
|---|---|---|---|---|
| 1,1-Dichloroethene SCHEMBL9054669 | 0.90 | — | — | |
| Ethylene SCHEMBL3669698 | 0.90 | — | — | |
| SCHEMBL2474821 | 0.89 | — | — | |
| SCHEMBL6432168 | 0.70 | — | — | |
| SCHEMBL813889 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL6432319 | 0.69 | — | — | |
| SCHEMBL22584 | 0.69 | — | — | |
| SCHEMBL8104299 | 0.69 | CYP2D6 (0.30) | — | |
| Fluoride Ion SCHEMBL5281606 | 0.68 | — | — | |
| SCHEMBL7108852 | 0.68 | — | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0805824-B1 | A SUPPORTED CATALYTIC ACTIVATOR | GRACE W R & CO (US) | 2002-04-24 | — | — | EP | claimed |
| US-20020006863-A1 | HALOGENATED SUPPORTS AND SUPPORTED ACTIVATORS | W.R. GRACE & CO.-CONN. | 2002-01-17 | — | — | US | claimed |
| US-20010018395-A1 | HALOGENATED SUPPORTS AND SUPPORTED ACTIVATORS | W.R. GRACE & CO.-CONN. | 2001-08-30 | — | — | US | claimed |
| EP-0830385-B1 | HALOGENATED SUPPORTS AND SUPPORTED ACTIVATORS | GRACE W R & CO (US) | 2000-12-27 | — | — | EP | claimed |
| EP-0830385-A1 | HALOGENATED SUPPORTS AND SUPPORTED ACTIVATORS | W.R. Grace & Co.-Conn. (US) | 1998-03-25 | — | — | EP | claimed |
| WO-1996040796-A1 | HALOGENATED SUPPORTS AND SUPPORTED ACTIVATORS | W.R. GRACE & CO.-CONN. (US) | 1996-12-19 | — | — | WO | claimed |
| US-6432863-B2 | FOR TRANSITION METAL CATALYST | W. R. GRACE & CO.-CONN. | 2002-08-13 | — | — | US | disclosed |
| US-6403518-B2 | MADE BY REACTING AN INORGANIC OR POLYMERIC CARRIER CONTAINING REACTIVE FUNCTIONALITIES WITH A HALOGENATED ORGANIC IN THE PRESENCE OF A BASE; TRANSITION METAL CATALYSTS FURTHER SUPPORTED ON THE CARRIER | W. R. GRACE & CO.-CONN. | 2002-06-11 | — | — | US | disclosed |
| EP-0805824-B1 | A SUPPORTED CATALYTIC ACTIVATOR | GRACE W R & CO (US) | 2002-04-24 | — | — | EP | disclosed |
| US-20020006863-A1 | HALOGENATED SUPPORTS AND SUPPORTED ACTIVATORS | W.R. GRACE & CO.-CONN. | 2002-01-17 | — | — | US | disclosed |
| US-20010018395-A1 | HALOGENATED SUPPORTS AND SUPPORTED ACTIVATORS | W.R. GRACE & CO.-CONN. | 2001-08-30 | — | — | US | disclosed |
| EP-0830385-B1 | HALOGENATED SUPPORTS AND SUPPORTED ACTIVATORS | GRACE W R & CO (US) | 2000-12-27 | — | — | EP | disclosed |
| US-5939347-A | Supported catalytic activator | W.R. GRACE & CO. -CONN. (US) | 1999-08-17 | — | — | US | disclosed |
| US-5885924-A | REACTING A CARRIER CONTAINING REACTIVE FUNCTIONALITIES, E.G., HYDROXYL CONTAINING SILICA, WITH HALOGENATED ORGANIC COMPOUNDS, E.G., FLUOROSUBSTITUTED PHENOLS, IN THE PRESENCE OF A BASE | W. R. GRACE & CO.-CONN. (US) | 1999-03-23 | — | — | US | disclosed |
| WO-1996040796-A1 | HALOGENATED SUPPORTS AND SUPPORTED ACTIVATORS | W.R. GRACE & CO.-CONN. (US) | 1996-12-19 | — | — | WO | disclosed |