⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13623495 | 0.95 | — | — | |
| SCHEMBL13623489 | 0.86 | — | — | |
| SCHEMBL12703336 | 0.83 | PGR (0.32) | — | |
| SCHEMBL12703412 | 0.82 | PGR (0.32) | — | |
| SCHEMBL13624465 | 0.82 | — | — | |
| SCHEMBL12333962 | 0.82 | — | — | |
| SCHEMBL13623642 | 0.81 | — | — | |
| SCHEMBL13623870 | 0.81 | — | — | |
| SCHEMBL14463331 | 0.80 | — | — | |
| SCHEMBL13623869 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009141026-A1 | COMPOUNDS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH, (DE) | 2009-11-26 | — | — | WO | disclosed |