⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19348730 | 0.79 | — | — | |
| SCHEMBL8340924 | 0.79 | ACHE (0.44) | — | |
| SCHEMBL6423255 | 0.79 | ACHE (0.39) | — | |
| SCHEMBL3262560 | 0.79 | — | — | |
| Phosphoric Acid SCHEMBL27915366 | 0.77 | ACHE (0.38) | — | |
| Hydrochloric Acid SCHEMBL11244451 | 0.77 | ACHE (0.38) | — | |
| Hydrochloric Acid SCHEMBL11243597 | 0.77 | ACHE (0.38) | — | |
| Hydrochloric Acid SCHEMBL11244454 | 0.77 | ACHE (0.38) | — | |
| SCHEMBL28781035 | 0.76 | — | — | |
| SCHEMBL29004820 | 0.76 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115799643-B | Nonaqueous electrolyte, lithium ion battery, battery module, battery pack, and power utilization device | 如鲲(江苏)新材料科技有限公司 | 2023-09-12 | — | — | CN | disclosed |
| CN-115799643-A | Nonaqueous electrolyte solution, lithium ion battery, battery module, battery pack, and electric device | 如鲲(江苏)新材料科技有限公司 | 2023-03-14 | — | — | CN | disclosed |
| CN-114728992-A | Method for producing phosphate compound | 斯泰拉化工公司 | 2022-07-08 | — | — | CN | disclosed |
| WO-1999018138-A1 | PREPARATION AND APPLICATIONS OF FLUORINATED PROPARGYL PHOSPHONATE REAGENTS | UNIVERSITY OF MASSACHUSETTS (US) | 1999-04-15 | — | — | WO | disclosed |