⚠ 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 | |
|---|---|---|---|---|
| Hydrogen Peroxide SCHEMBL9111065 | 0.92 | — | — | |
| SCHEMBL30492 | 0.88 | — | — | |
| SCHEMBL27500493 | 0.88 | — | — | |
| SCHEMBL30805813 | 0.84 | — | — | |
| SCHEMBL31366005 | 0.84 | — | — | |
| SCHEMBL30167411 | 0.84 | — | — | |
| Phosphine SCHEMBL5033463 | 0.84 | — | — | |
| SCHEMBL1502380 | 0.84 | — | — | |
| Methane SCHEMBL196647 | 0.84 | — | — | |
| SCHEMBL8928294 | 0.84 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115172606-A | Perovskite solar cell based on homojunction interface crosslinking and preparation method thereof | 华北电力大学 | 2022-10-11 | — | — | CN | disclosed |
| CN-114638513-A | Radioactive waste solidification treatment evaluation method and alternative nuclide feasibility evaluation method | 中广核研究院有限公司 | 2022-06-17 | — | — | CN | disclosed |
| CN-106146811-A | A kind of high-purity medical high polymer and preparation method thereof | 张锐 | 2016-11-23 | — | — | CN | disclosed |