⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9717932 | 0.83 | PTPN7 (0.45) | — | |
| SCHEMBL19959103 | 0.83 | PTPN7 (0.45) | — | |
| SCHEMBL3402071 | 0.83 | TSHR (0.44) | — | |
| SCHEMBL29625159 | 0.81 | PTPN7 (0.48) | — | |
| SCHEMBL29625174 | 0.81 | PTPN7 (0.48) | — | |
| SCHEMBL9712206 | 0.81 | PTPN7 (0.48) | — | |
| SCHEMBL9135760 | 0.81 | PTPN7 (0.48) | — | |
| SCHEMBL4534135 | 0.79 | — | — | |
| SCHEMBL18679893 | 0.78 | — | — | |
| SCHEMBL487731 | 0.78 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7619125-B2 | Hydrogenation promoter, hydrogenation catalyst, and process for producing alkene compound | KANTO KAGAKU KABUSHIKI KAISHA (JP) | 2009-11-17 | — | — | US | disclosed |
| US-20080033221-A1 | Hydrogenation Promoter, Hydrogenation Catalyst, and Process for Producing Alkene Compound | NAGOYA INDUSTRIAL SCIENCE RESEARCH INSTITUTE (JP) | 2008-02-07 | — | — | US | disclosed |
| US-5620677-A | CONTRAST AGENTS IN DIAGNOSTIC RADIOLOGY | STERLING WINTHROP INC. (US) | 1997-04-15 | — | — | US | disclosed |
| US-5607660-A | X-RAY CONTRAST AGENTS FOR INTESTINES | STERLING WINTHROP INC. (US) | 1997-03-04 | — | — | US | disclosed |
| US-5531979-A | X-RAY CONTRAST COMPOSITION | STERLING WINTHROP INC. (US) | 1996-07-02 | — | — | US | disclosed |
| EP-0609586-A2 | Compositions of iodophenoxy alkanes and iodophenyl ethers for visualization of the gastrointestinal tract | NYCOMED IMAGING AS (NO) | 1994-08-10 | — | — | EP | disclosed |
| EP-0609587-A2 | Compositions of iodophenoxy alkanes and iodophenyl ethers in film-forming materials for visualization of the gastrointestinal tract | NYCOMED IMAGING AS (NO) | 1994-08-10 | — | — | EP | disclosed |
| US-5326553-A | Compositions of iodophenoxy alkanes and iodophenyl ethers in film-forming materials for visualization of the gastrointestinal tract | STERLING WINTHROP INC. (US) | 1994-07-05 | — | — | US | disclosed |
| US-5316755-A | AQUEOUS X-RAY CONTRAST COMPOSITION FOR ORAL OR RECTAL ADMINISTRATION | STERLING WINTHROP INC. (US) | 1994-05-31 | — | — | US | disclosed |
| US-4179561-A | REACTING A 3-DIAZOOXINDOLE WITH A SUBSTITUTED ACETYLENE | E. R. SQUIBB & SONS, INC. (US) | 1979-12-18 | — | — | US | disclosed |
| US-4112096-A | ANTIALLERGENS | E. R. SQUIBB & SONS, INC. (US) | 1978-09-05 | — | — | US | disclosed |
| US-4111917-A | POLYURETHANES | W. R. GRACE & CO. (US) | 1978-09-05 | — | — | US | disclosed |
| US-4076818-A | ANTIALLERGENS | E. R. SQUIBB & SONS, INC. (US) | 1978-02-28 | — | — | US | disclosed |
| US-3935269-A | Copolymers of N-substituted aziridines and epoxides episulfides | THE DOW CHEMICAL COMPANY (US) | 1976-01-27 | — | — | US | disclosed |