⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12582193 | 1.00 | — | — | |
| SCHEMBL14161071 | 0.82 | — | — | |
| SCHEMBL18380858 | 0.78 | — | — | |
| SCHEMBL15043832 | 0.72 | — | — | |
| SCHEMBL20384889 | 0.72 | — | — | |
| SCHEMBL25024453 | 0.72 | — | — | |
| SCHEMBL13271151 | 0.72 | — | — | |
| SCHEMBL21872753 | 0.72 | — | — | |
| SCHEMBL13863839 | 0.72 | — | — | |
| SCHEMBL24860359 | 0.72 | — | — |
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-1148109-B1 | Organic electroluminescent device | TDK CORP (JP) | 2011-07-06 | — | — | EP | disclosed |
| WO-2008067644-A1 | INHIBITORS OF HIV REPLICATION | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-06-12 | — | — | WO | disclosed |