⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12646766 | 1.00 | — | — | |
| SCHEMBL19840325 | 0.90 | — | — | |
| SCHEMBL12646767 | 0.89 | P2RY14 (0.34) | — | |
| SCHEMBL12590138 | 0.89 | P2RY14 (0.34) | — | |
| SCHEMBL12590139 | 0.85 | CHEK1 (0.33) | — | |
| SCHEMBL12646765 | 0.85 | CHEK1 (0.33) | — | |
| SCHEMBL19840324 | 0.78 | P2RY14 (0.35) | — | |
| SCHEMBL19884481 | 0.77 | ADORA1 (0.35) | — | |
| SCHEMBL19840323 | 0.74 | CHEK1 (0.32) | — | |
| SCHEMBL16587616 | 0.73 | P2RY2 (0.55) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20110152353-A1 | DOUBLE-STRANDED POLYNUCLEOTIDE | DAIICHI SANKYO COMPANY, LIMITED | 2011-06-23 | — | — | US | disclosed |