⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5986329 | 0.77 | LMNA (0.35) | — | |
| SCHEMBL7795156 | 0.74 | LMNA (0.35) | — | |
| SCHEMBL5986323 | 0.73 | — | — | |
| SCHEMBL27595690 | 0.71 | LMNA (0.33) | — | |
| SCHEMBL13557948 | 0.68 | LMNA (0.44) | — | |
| SCHEMBL7602442 | 0.64 | DRD2 (0.49) | — | |
| SCHEMBL7796854 | 0.63 | LMNA (0.31) | — | |
| SCHEMBL11989074 | 0.62 | — | — | |
| SCHEMBL4489686 | 0.62 | MEN1 (0.34) | — | |
| SCHEMBL5986541 | 0.62 | DRD2 (0.50) | — |
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-2010150840-A1 | N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE | 大日本住友製薬株式会社 (JP) | 2010-12-29 | — | — | WO | disclosed |