⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2161853 | 0.76 | — | — | |
| SCHEMBL9626195 | 0.73 | — | — | |
| SCHEMBL6060235 | 0.67 | — | — | |
| SCHEMBL4119428 | 0.66 | — | — | |
| SCHEMBL968524 | 0.65 | — | — | |
| SCHEMBL3101799 | 0.64 | — | — | |
| SCHEMBL13019258 | 0.64 | — | — | |
| SCHEMBL13816572 | 0.64 | — | — | |
| SCHEMBL29854 | 0.62 | — | — | |
| SCHEMBL16544543 | 0.62 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110312757-A | Ethene-alpha-olefin copolymer-triallyl phosphate composition | 陶氏环球技术有限责任公司 | 2019-10-08 | — | — | CN | claimed |
| EP-2668035-A1 | PRIMER COMPOSITION AND LAMINATE | Dow Corning Toray Co., Ltd. (JP) | 2013-12-04 | — | — | EP | disclosed |
| WO-2012102412-A1 | PRIMER COMPOSITION AND LAMINATE | DOW CORNING TORAY CO., LTD. (JP) | 2012-08-02 | — | — | WO | disclosed |
| US-5985446-A | Acetylenic carbon allotrope | LAGOW RICHARD J (US) | 1999-11-16 | — | — | US | disclosed |
| EP-0821702-A4 | AN ACETYLENIC CARBON ALLOTROPE | LAGOW RICHARD J (US) | 1998-04-29 | — | — | EP | disclosed |
| US-5716708-A | Acetylenic carbon allotrope | LAGOW RICHARD J (US) | 1998-02-10 | — | — | US | disclosed |
| EP-0821702-A1 | AN ACETYLENIC CARBON ALLOTROPE | Lagow, Richard J. (US) | 1998-02-04 | — | — | EP | disclosed |
| WO-1996022314-A1 | AN ACETYLENIC CARBON ALLOTROPE | LAGOW RICHARD J (US) | 1996-07-25 | — | — | WO | disclosed |
| US-5286901-A | Prescursors for and synthesis of mono- and difunctionalized acetylenes and difunctional 1,3-diynes | UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) | 1994-02-15 | — | — | US | disclosed |
| US-5091488-A | POLYETHYLACETYLENE DERIVATIVE AND PROCESS FOR PREPARATION THEREOF | DIRECTOR-GENERAL OF AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 1992-02-25 | — | — | US | disclosed |