⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6013507 | 1.00 | — | — | |
| SCHEMBL3948946 | 0.95 | — | — | |
| Ammonia Solution, Strong SCHEMBL28116812 | 0.95 | — | — | |
| SCHEMBL27074401 | 0.95 | — | — | |
| SCHEMBL15547959 | 0.94 | TDP1 (0.31) | — | |
| SCHEMBL15547958 | 0.94 | TDP1 (0.31) | — | |
| SCHEMBL6244 | 0.94 | — | — | |
| Ammonia Solution, Strong SCHEMBL28829446 | 0.91 | — | — | |
| SCHEMBL9696665 | 0.91 | — | — | |
| SCHEMBL2129648 | 0.89 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109422641-A | The continuous producing method of calcium formate is prepared by yellow phosphoric tail gas | 天津大学 | 2019-03-05 | — | — | CN | disclosed |
| CN-108349732-A | Hydrogen and calcium carbonate are prepared by formaldehyde | 沙特基础工业全球技术公司 | 2018-07-31 | — | — | CN | disclosed |
| CN-1395555-A | Calcium dicarboxylate ethers, method of making same, and treatment of vascular disease and diabetes therewith | WARNER LAMBERT CO (US) | 2003-02-05 | — | — | CN | disclosed |
| WO-1995024452-A1 | DRILLING FLUIDS | SCOTOIL SERVICES LTD. (GB) | 1995-09-14 | — | — | WO | disclosed |