⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL784177 | 0.78 | — | — | |
| Isobutane SCHEMBL4756202 | 0.73 | ALDH1A1 (0.33) | — | |
| Isobutane SCHEMBL1691786 | 0.73 | ALDH1A1 (0.33) | — | |
| SCHEMBL13967773 | 0.72 | — | — | |
| Isobutane SCHEMBL23014455 | 0.70 | ALDH1A1 (0.31) | — | |
| Isobutane SCHEMBL4756106 | 0.70 | ALDH1A1 (0.31) | — | |
| Isobutane SCHEMBL11438447 | 0.70 | ALDH1A1 (0.31) | — | |
| Isobutane SCHEMBL11143719 | 0.70 | ALDH1A1 (0.31) | — | |
| Isobutane SCHEMBL23014394 | 0.70 | ALDH1A1 (0.31) | — | |
| Isobutane SCHEMBL5164604 | 0.70 | ALDH1A1 (0.31) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240238325-A1 | Artificial Nucleic Acid and Method for Delivery of Nucleic Acid Using the Same | JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) | 2024-07-18 | — | — | US | disclosed |
| US-11840551-B2 | Compositions and methods of modulating the immune response by activating alpha protein kinase 1 | SHANGHAI YAO YUAN BIOTECHNOLOGY CO., LTD. (CN) | 2023-12-12 | — | — | US | disclosed |
| US-11773131-B2 | Compositions and methods of modulating the immune response by activating alpha protein kinase 1 | SHANGHAI YAO YUAN BIOTECHNOLOGY CO., LTD. (CN) | 2023-10-03 | — | — | US | disclosed |
| US-11638717-B2 | Complex of nucleic acid medicine and multibranched lipid | SHIONOGI & CO., LTD. (JP) | 2023-05-02 | — | — | US | disclosed |
| US-9302274-B2 | Collector compositions and methods of using the same | CYTEC TECHNOLOGY CORP. (US) | 2016-04-05 | — | — | US | disclosed |
| US-20130092603-A1 | Collector Compositions and Methods of Using the Same | CYTEC TECHNOLOGY CORP. (US) | 2013-04-18 | — | — | US | disclosed |
| US-4661278-A | Monothiophosphinates as acid, neutral, or mildly alkaline circuit sulfide collectors and process for using same | AMERICAN CYANAMID COMPANY (US) | 1987-04-28 | — | — | US | disclosed |
| US-4587013-A | Monothiophosphinates as acid, neutral, or mildly alkaline circuit sulfide collectors and process for using same | AMERICAN CYANAMID COMPANY (US) | 1986-05-06 | — | — | US | disclosed |
| US-4399075-A | Process for producing chlorinated phenoxytoluene derivatives | ASAHI CHEMICAL COMPANY, LIMITED (JP) | 1983-08-16 | — | — | US | disclosed |