⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL779908 | 0.69 | — | — | |
| SCHEMBL776551 | 0.67 | — | — | |
| Dimethyl Sulfoxide SCHEMBL27557207 | 0.57 | — | — | |
| SCHEMBL78022 | 0.54 | — | — | |
| SCHEMBL2212030 | 0.54 | — | — | |
| Dimethyl Sulfoxide SCHEMBL619881 | 0.54 | — | — | |
| SCHEMBL2214957 | 0.54 | — | — | |
| Dimethyl Sulfoxide SCHEMBL4214895 | 0.51 | ALDH1A1 (0.55) | — | |
| SCHEMBL161626 | 0.51 | — | — | |
| Dimethyl Sulfoxide SCHEMBL688092 | 0.51 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3147283-A1 | HYDRAZINE COMPOUND AS BLOOD COAGULATION FACTOR Xa INHIBITOR | North China Pharmaceutical Company., Ltd. (CN) | 2017-03-29 | — | — | EP | disclosed |