⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10253703 | 0.81 | — | — | |
| SCHEMBL21679771 | 0.77 | EGLN1 (0.45) | — | |
| Malonic Acid SCHEMBL5996614 | 0.75 | TP53 (0.69) | — | |
| Malonic Acid SCHEMBL30288562 | 0.74 | LDHA (0.64) | — | |
| SCHEMBL12497823 | 0.73 | ALOX15 (0.35) | — | |
| Itaconate SCHEMBL28065371 | 0.73 | ALOX15 (0.56) | — | |
| SCHEMBL6058674 | 0.72 | — | — | |
| SCHEMBL165376 | 0.72 | — | — | |
| SCHEMBL5685805 | 0.72 | — | — | |
| Itaconate SCHEMBL28350321 | 0.72 | ALOX15 (0.60) | — |
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-115053641-A | Through hole filling method of circuit board and circuit board using same | ＹＭＴ股份有限公司 | 2022-09-13 | — | — | CN | disclosed |