⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL940429 | 0.83 | — | — | |
| SCHEMBL155021 | 0.80 | — | — | |
| SCHEMBL10509978 | 0.80 | — | — | |
| SCHEMBL28263965 | 0.80 | LMNA (0.48) | — | |
| SCHEMBL27930890 | 0.78 | LMNA (0.64) | — | |
| SCHEMBL19492877 | 0.74 | LMNA (0.52) | — | |
| SCHEMBL5228873 | 0.74 | — | — | |
| SCHEMBL5154336 | 0.74 | LMNA (0.65) | — | |
| SCHEMBL17467946 | 0.72 | LMNA (0.50) | — | |
| SCHEMBL2024839 | 0.72 | LMNA (0.44) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109608404-A | A kind of preparation method of 4,6- dichloro pyrimidine -5- acetaldehyde | 上海卡洛化学有限公司 | 2019-04-12 | — | — | CN | claimed |
| CN-109608404-A | A kind of preparation method of 4,6- dichloro pyrimidine -5- acetaldehyde | 上海卡洛化学有限公司 | 2019-04-12 | — | — | CN | disclosed |