⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15369599 | 1.00 | — | — | |
| SCHEMBL10305697 | 0.76 | — | — | |
| SCHEMBL15369617 | 0.76 | — | — | |
| SCHEMBL11653031 | 0.74 | — | — | |
| SCHEMBL15173830 | 0.74 | — | — | |
| SCHEMBL10305686 | 0.71 | — | — | |
| SCHEMBL9217366 | 0.71 | USP2 (0.31) | — | |
| SCHEMBL5546809 | 0.71 | USP2 (0.31) | — | |
| SCHEMBL14599879 | 0.69 | — | — | |
| SCHEMBL7163926 | 0.69 | — | — |
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-2474548-A1 | Preparation process of an antiviral drug and intermediates thereof | Esteve Química, S.A. (ES) | 2012-07-11 | — | — | EP | disclosed |
| WO-2012085209-A1 | PREPARATION PROCESS OF AN ANTIVIRAL DRUG (ENTECAVIR) AND INTERMEDIATES THEREOF | Esteve Química, S.A. (ES) | 2012-06-28 | — | — | WO | disclosed |