⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15641232 | 0.79 | — | — | |
| SCHEMBL13777918 | 0.75 | — | — | |
| SCHEMBL1479772 | 0.74 | — | — | |
| SCHEMBL12753028 | 0.74 | — | — | |
| SCHEMBL16949306 | 0.74 | — | — | |
| SCHEMBL1479776 | 0.74 | — | — | |
| SCHEMBL8737440 | 0.74 | — | — | |
| SCHEMBL7421040 | 0.72 | — | — | |
| SCHEMBL17187469 | 0.72 | — | — | |
| SCHEMBL12391901 | 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 |
|---|---|---|---|---|---|---|---|
| US-20180175305-A1 | AZAAZENE ANALOGUES AND THEIR USE AS SEMICONDUCTOR | BASF SE (DE) | 2018-06-21 | — | — | US | disclosed |
| US-20120101091-A1 | VIRAL POLYMERASE INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-04-26 | — | — | US | disclosed |