⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27818836 | 0.79 | — | — | |
| SCHEMBL9178915 | 0.77 | — | — | |
| SCHEMBL27838546 | 0.73 | — | — | |
| SCHEMBL18837077 | 0.69 | — | — | |
| SCHEMBL27912328 | 0.65 | — | — | |
| SCHEMBL8158968 | 0.65 | — | — | |
| Bromide SCHEMBL5406114 | 0.62 | — | — | |
| SCHEMBL14954218 | 0.62 | — | — | |
| Bromide SCHEMBL14953869 | 0.62 | — | — | |
| SCHEMBL4871091 | 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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5705571-A | HYDROGENATION USING BIS(CYCLOPENTADIENYL) GROUP VIII TRANSITION METAL COMPOUND AND ORGANOLITHIUM COMPOUND MIXTURE CATALYST | TAIWAN SYNTHETIC RUBBER CORPORATION (TW) | 1998-01-06 | — | — | US | claimed |
| JP-62207868-A | — | — | None | — | — | JP | disclosed |
| CN-117720472-A | Benzimidazole compound, and preparation method and application thereof | 苏州沪云新药研发股份有限公司 | 2024-03-19 | — | — | CN | disclosed |
| US-20120225771-A1 | METHOD FOR PRODUCING CATALYST-SUPPORTING CARRIER AND APPARATUS FOR PRODUCING SAME | RICOH COMPANY, LTD. (JP) | 2012-09-06 | — | — | US | disclosed |
| US-6657069-B2 | Reacting 6-aminocarbonylmethyl-4H-2,3- dioxin-4-one compound with alcohol or water to produce 3-oxopentanedicarboxylic acid amide esters; decyclization | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2003-12-02 | — | — | US | disclosed |
| US-20030130519-A1 | Amido compounds and process for producing the same | DAICEL CHEMICAL INDUSTRIES, LTD. | 2003-07-10 | — | — | US | disclosed |
| US-6548674-B2 | 6-aminocarbonylmethyl-4H-1,3-dioxin-4-ones made by reacting a 6-halomethyl-4H-1,3-dioxin-4-ones with primary or secondary amine and carbon monoxide; intermediate to 3-oxopentanedicarboxylic acid amides for drugs, polyamides | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2003-04-15 | — | — | US | disclosed |
| US-6462223-B2 | REACTING A 6-HALOMETHYL-4H-1,3-DIOXIN-4-ONE DERIVATIVE WITH CARBON MONOXIDE AND AN ALCOHOL OR WATER | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2002-10-08 | — | — | US | disclosed |
| CN-1079091-C | Process for the dimerization of lower olefins | KYOWA YUKA KK (JP) | 2002-02-13 | — | — | CN | disclosed |
| US-20010051758-A1 | PROCESS FOR THE DIMERIZATION OF LOWER OLEFINS | KYOWA YUKA CO., LTD. (JP) | 2001-12-13 | — | — | US | disclosed |
| US-6297388-B1 | 6-ALKOXYCARBONYLMETHYL-4H-1,3-DIOXIN-4-ONES PRODUCED BY REACTING A 6-HALOMETHYL-4H-1,3-DIOXIN-4-ONE WITH CARBON MONOXIDE, AN ALCOHOL OR WATER, AND 3-OXOPENTANEDICARBOXYLIC ACID ESTERS FURTHER PRODUCED BY REACTING ABOVE DERIVATIVES | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2001-10-02 | — | — | US | disclosed |
| US-20010023297-A1 | Amido compounds and process for producing the same | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 2001-09-20 | — | — | US | disclosed |
| EP-1132386-A1 | Amido compounds and process for producing the same | Daicel Chemical Industries, Ltd. (JP) | 2001-09-12 | — | — | EP | disclosed |
| US-20010020103-A1 | Ester and process for producing the same | DAICEL CHEMICAL INDUSTRIES, LTD. | 2001-09-06 | — | — | US | disclosed |
| EP-1097931-A1 | 2-(4-Oxo-4H-1,3-dioxin-6-yl)acetates | Daicel Chemical Industries, Ltd. (JP) | 2001-05-09 | — | — | EP | disclosed |
| CN-1215386-A | Process for the dimerization of lower olefins | KYOWA YUKA KK (JP) | 1999-04-28 | — | — | CN | disclosed |
| EP-0908436-A1 | PROCESS FOR THE DIMERIZATION OF LOWER OLEFINS | Kyowa Yuka Co., Ltd. (JP) | 1999-04-14 | — | — | EP | disclosed |
| US-5705571-A | HYDROGENATION USING BIS(CYCLOPENTADIENYL) GROUP VIII TRANSITION METAL COMPOUND AND ORGANOLITHIUM COMPOUND MIXTURE CATALYST | TAIWAN SYNTHETIC RUBBER CORPORATION (TW) | 1998-01-06 | — | — | US | disclosed |
| JP-S62207868-A | FORMATION OF THIN METALLIC FILM | NIPPON ENGERUHARUDO KK | 1987-09-12 | — | — | JP | disclosed |