⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21806014 | 0.68 | MKNK1 (0.47) | — | |
| SCHEMBL30940314 | 0.68 | ALDH1A1 (0.52) | — | |
| SCHEMBL3277728 | 0.68 | ALDH1A1 (0.52) | — | |
| SCHEMBL12615990 | 0.67 | ALDH1A1 (0.38) | — | |
| SCHEMBL14217428 | 0.67 | ALDH1A1 (0.34) | — | |
| SCHEMBL101638 | 0.67 | — | — | |
| SCHEMBL11361203 | 0.66 | HSD17B10 (0.36) | — | |
| SCHEMBL3327873 | 0.65 | GAA (0.34) | — | |
| SCHEMBL19555244 | 0.65 | LMNA (0.30) | — | |
| SCHEMBL11146024 | 0.65 | ALDH1A1 (0.38) | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117903142-A | Synthetic method of initiating explosive ICM-103 | 中北大学 | 2024-04-19 | — | — | CN | claimed |
| CN-117903143-A | Synthetic method of initiating explosive ICM-103 and intermediate thereof | 中北大学 | 2024-04-19 | — | — | CN | claimed |
| US-11247997-B2 | Compound and preparation and application thereof | INSTITUTE OF CHEMICAL MATERIALS OF CHINA ACADEMY OF ENGINEERING AND PHYSICS (CN) | 2022-02-15 | — | — | US | claimed |
| CN-108752349-B | Green environment-friendly initiating explosive and preparation method thereof | 中国工程物理研究院化工材料研究所 | 2020-06-16 | — | — | CN | claimed |
| EP-3660019-A1 | COMPOUND AND PREPARATION AND APPLICATION THEREOF | Institute of Chemical Materials of China Academy of Engineering and Physics (CN) | 2020-06-03 | — | — | EP | claimed |
| WO-2020034601-A1 | COMPOUND AND PREPARATION AND APPLICATION THEREOF | 中国工程物理研究院化工材料研究所 | 2020-02-20 | — | — | WO | claimed |
| CN-117946117-A | Green initiating explosive ICM-103 spherical crystal and preparation method thereof | 中北大学 | 2024-04-30 | — | — | CN | disclosed |
| CN-117903142-A | Synthetic method of initiating explosive ICM-103 | 中北大学 | 2024-04-19 | — | — | CN | disclosed |
| CN-117903142-A | Synthetic method of initiating explosive ICM-103 | 中北大学 | 2024-04-19 | — | — | CN | disclosed |
| CN-117903143-A | Synthetic method of initiating explosive ICM-103 and intermediate thereof | 中北大学 | 2024-04-19 | — | — | CN | disclosed |
| EP-3660019-B1 | 7H-PYRAZOLO[3,4-D]TRIAZINE-2-OXIDES AS EXPLOSIVES | INSTITUTE OF CHEMICAL MAT OF CHINA ACADEMY OF ENGINEERING AND PHYSICS (CN) | 2023-12-20 | — | — | EP | disclosed |
| US-11247997-B2 | Compound and preparation and application thereof | INSTITUTE OF CHEMICAL MATERIALS OF CHINA ACADEMY OF ENGINEERING AND PHYSICS (CN) | 2022-02-15 | — | — | US | disclosed |
| US-20210155624-A1 | COMPOUND AND PREPARATION AND APPLICATION THEREOF | INSTITUTE OF CHEMICAL MATERIALS OF CHINA ACADEMY OF ENGINEERING AND PHYSICS (CN) | 2021-05-27 | — | — | US | disclosed |
| CN-108752349-B | Green environment-friendly initiating explosive and preparation method thereof | 中国工程物理研究院化工材料研究所 | 2020-06-16 | — | — | CN | disclosed |
| CN-108752349-B | Green environment-friendly initiating explosive and preparation method thereof | 中国工程物理研究院化工材料研究所 | 2020-06-16 | — | — | CN | disclosed |
| EP-3660019-A1 | COMPOUND AND PREPARATION AND APPLICATION THEREOF | Institute of Chemical Materials of China Academy of Engineering and Physics (CN) | 2020-06-03 | — | — | EP | disclosed |
| WO-2020034601-A1 | COMPOUND AND PREPARATION AND APPLICATION THEREOF | 中国工程物理研究院化工材料研究所 | 2020-02-20 | — | — | WO | disclosed |
| WO-2020034601-A1 | COMPOUND AND PREPARATION AND APPLICATION THEREOF | 中国工程物理研究院化工材料研究所 | 2020-02-20 | — | — | WO | disclosed |