⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4532147 | 0.86 | — | — | |
| SCHEMBL276069 | 0.85 | TSHR (0.36) | — | |
| SCHEMBL26632829 | 0.84 | SPHK1 (0.46) | — | |
| SCHEMBL10617834 | 0.82 | SPHK1 (0.50) | — | |
| SCHEMBL6466390 | 0.82 | SPHK1 (0.50) | — | |
| SCHEMBL8836714 | 0.82 | SPHK1 (0.50) | — | |
| SCHEMBL28339798 | 0.82 | SPHK1 (0.50) | — | |
| SCHEMBL5185073 | 0.80 | HMGCR (0.42) | — | |
| SCHEMBL720248 | 0.78 | — | — | |
| SCHEMBL28888107 | 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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009124157-A1 | INK JET INK AND INK SET | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2009-10-08 | — | — | WO | claimed |
| CN-114008824-A | Alkali metal electrode treatment agent, electrolyte for alkali metal secondary battery, alkali metal electrode, alkali metal secondary battery, and module | 大金工业株式会社 | 2022-02-01 | — | — | CN | disclosed |
| CN-113994518-A | Electrolyte, secondary battery and module | 大金工业株式会社 | 2022-01-28 | — | — | CN | disclosed |
| CN-113950765-A | Electrolyte for alkali metal ion secondary battery, and module | 大金工业株式会社 | 2022-01-18 | — | — | CN | disclosed |
| US-11174275-B2 | Methods for the preparation of cyclopentaoxasilinones and cyclopentaoxaborininones and their use | DREXEL UNIVERSITY (US) | 2021-11-16 | — | — | US | disclosed |
| CN-113508485-A | Electrolyte solution, electrochemical device, lithium ion secondary battery, and module | 大金工业株式会社 | 2021-10-15 | — | — | CN | disclosed |
| CN-113490674-A | Compound, additive for electrolytic solution, electrochemical device, lithium ion secondary battery, and module | 大金工业株式会社 | 2021-10-08 | — | — | CN | disclosed |
| CN-113474932-A | Electrolyte solution, electrochemical device, lithium ion secondary battery, module, and compound | 大金工业株式会社 | 2021-10-01 | — | — | CN | disclosed |
| CN-113261140-A | Electrolyte for lithium ion secondary battery, and module | 大金工业株式会社 | 2021-08-13 | — | — | CN | disclosed |
| US-20210054003-A1 | Methods for the preparation of cyclopentaoxasilinones and cyclopentaoxaborininones and their use | DREXEL UNIVERSITY | 2021-02-25 | — | — | US | disclosed |
| 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-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-4076818-A | ANTIALLERGENS | E. R. SQUIBB & SONS, INC. (US) | 1978-02-28 | — | — | US | disclosed |