⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL145589 | 0.74 | NOS3 (0.38) | — | |
| Bromide SCHEMBL1321516 | 0.72 | NOS3 (0.36) | — | |
| SCHEMBL11225503 | 0.72 | — | — | |
| SCHEMBL20746107 | 0.70 | — | — | |
| SCHEMBL17030207 | 0.68 | NOS3 (0.33) | — | |
| SCHEMBL17029967 | 0.68 | — | — | |
| SCHEMBL19522862 | 0.67 | — | — | |
| SCHEMBL11148579 | 0.66 | — | — | |
| Isopropyl Alcohol SCHEMBL28321098 | 0.65 | NOS3 (0.31) | — | |
| SCHEMBL22589402 | 0.65 | NOS3 (0.36) | — |
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-110267744-A | The purifying and measurement and mutation and/or the common measurement of mRNA expression of the integration of DNA methylation in automation reaction box | 塞弗德公司 | 2019-09-20 | — | — | CN | disclosed |
| CN-107922941-A | The purifying and measurement and mutation and/or the common measurement of mRNA expressions of the integration of DNA methylation in reaction box is automated | 塞弗德公司 | 2018-04-17 | — | — | CN | disclosed |