⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15369581 | 0.81 | — | — | |
| SCHEMBL880177 | 0.69 | — | — | |
| SCHEMBL11381693 | 0.59 | — | — | |
| SCHEMBL170972 | 0.57 | — | — | |
| SCHEMBL13668787 | 0.56 | — | — | |
| SCHEMBL20338771 | 0.56 | — | — | |
| SCHEMBL7930289 | 0.56 | CA1 (0.33) | — | |
| SCHEMBL10054684 | 0.56 | — | — | |
| SCHEMBL15865292 | 0.54 | — | — | |
| SCHEMBL8707192 | 0.54 | — | — |
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 |