⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10448240 | 0.97 | — | — | |
| SCHEMBL10447695 | 0.76 | — | — | |
| SCHEMBL4120220 | 0.75 | — | — | |
| SCHEMBL4126824 | 0.74 | AKR1C1 (0.34) | — | |
| SCHEMBL4119130 | 0.74 | KMT2A (0.31) | — | |
| SCHEMBL4130532 | 0.73 | APOBEC3A (0.34) | — | |
| SCHEMBL10380439 | 0.72 | LMNA (0.32) | — | |
| SCHEMBL4126239 | 0.72 | — | — | |
| SCHEMBL187155 | 0.71 | — | — | |
| SCHEMBL4124776 | 0.70 | MMP1 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1028993-C | Nucleic acid derivatives | NIPPON KAYAKN K K (JP) | 1995-06-21 | — | — | CN | disclosed |
| CN-1059524-A | New nucleic acid derivative | NIPPON KAYAKN KABUSHIK KAISHA (JP) | 1992-03-18 | — | — | CN | disclosed |