⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1275144 | 0.97 | — | — | |
| SCHEMBL18925520 | 0.79 | — | — | |
| SCHEMBL23879906 | 0.76 | — | — | |
| SCHEMBL3071363 | 0.76 | — | — | |
| SCHEMBL10200212 | 0.76 | — | — | |
| SCHEMBL10014404 | 0.73 | — | — | |
| SCHEMBL2112190 | 0.73 | CYP2C19 (0.42) | — | |
| SCHEMBL8340216 | 0.73 | — | — | |
| SCHEMBL9838493 | 0.73 | CYP2C19 (0.38) | — | |
| SCHEMBL8762036 | 0.72 | HDAC3 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118203103-A | Natural sweetness enhancer composition | 伊比西(北京)植物药物技术有限公司 | 2024-06-18 | — | — | CN | disclosed |