⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL50123 | 0.93 | — | — | |
| SCHEMBL17004026 | 0.93 | — | — | |
| Ethylene SCHEMBL27577658 | 0.88 | — | — | |
| SCHEMBL28942470 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL11274092 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL11409106 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL3362939 | 0.86 | — | — | |
| SCHEMBL3359476 | 0.86 | — | — | |
| Fluoride SCHEMBL34460639 | 0.86 | — | — | |
| SCHEMBL29110032 | 0.86 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-108064293-A | D Hepatitis virus (HDV) iRNA compositions and its application method | 阿尔尼拉姆医药品有限公司 | 2018-05-22 | — | — | CN | disclosed |