⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28263220 | 0.76 | — | — | |
| SCHEMBL7097725 | 0.74 | — | — | |
| SCHEMBL5544690 | 0.74 | MEN1 (0.42) | — | |
| SCHEMBL1746 | 0.74 | — | — | |
| Ethylamine SCHEMBL8329983 | 0.72 | MEN1 (0.36) | — | |
| Hydrazine SCHEMBL28180292 | 0.72 | MEN1 (0.36) | — | |
| Isopropylamine SCHEMBL28909420 | 0.72 | MEN1 (0.36) | — | |
| SCHEMBL319537 | 0.71 | MEN1 (0.40) | — | |
| Ammonia Solution, Strong SCHEMBL1997314 | 0.71 | MEN1 (0.40) | — | |
| Hydrochloric Acid SCHEMBL22577541 | 0.71 | MEN1 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2648826-A1 | PROCESS FOR REMOVING CARBON DIOXIDE FROM A GAS STREAM | Shell Internationale Research Maatschappij B.V. (NL) | 2013-10-16 | — | — | EP | claimed |
| WO-2012076597-A1 | PROCESS FOR REMOVING CARBON DIOXIDE FROM A GAS STREAM | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2012-06-14 | — | — | WO | claimed |