⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL345348 | 0.85 | — | — | |
| Water SCHEMBL28118736 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL41574 | 0.83 | — | — | |
| Acetic Acid SCHEMBL548254 | 0.82 | FFAR3 (0.32) | — | |
| Ammonia Solution, Strong SCHEMBL5403387 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL7133508 | 0.72 | TERT (0.33) | — | |
| Formic Acid SCHEMBL27989129 | 0.71 | — | — | |
| Formic Acid SCHEMBL27279500 | 0.68 | — | — | |
| SCHEMBL25141941 | 0.64 | — | — | |
| SCHEMBL2183778 | 0.64 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109574901-A | The preparation method of 3- maleimide yl benzoic acid succinimide ester | 苏州昊帆生物股份有限公司 | 2019-04-05 | — | — | CN | disclosed |