⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18349453 | 0.89 | — | — | |
| SCHEMBL12403737 | 0.79 | — | — | |
| SCHEMBL20665404 | 0.78 | CACNA1F (0.35) | — | |
| SCHEMBL27420004 | 0.78 | MAPK1 (0.31) | — | |
| SCHEMBL10246313 | 0.73 | TAS1R3 (0.33) | — | |
| SCHEMBL18893422 | 0.70 | TAS1R3 (0.30) | — | |
| SCHEMBL17630152 | 0.70 | TGFBR1 (0.35) | — | |
| SCHEMBL22401895 | 0.70 | — | — | |
| SCHEMBL22648979 | 0.70 | MAPK1 (0.43) | — | |
| SCHEMBL20850030 | 0.69 | CA1 (0.32) | — |
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-20160376585-A1 | OLIGONUCLEOTIDE-LIGAND CONJUGATES AND PROCESS FOR THEIR PREPARATION | BANK OF AMERICA, N.A. | 2016-12-29 | — | — | US | disclosed |