⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28535845 | 0.79 | — | — | |
| SCHEMBL28907927 | 0.79 | ALDH1A1 (0.32) | — | |
| SCHEMBL28527344 | 0.76 | AR (0.32) | — | |
| SCHEMBL28526867 | 0.73 | SMN1; SMN2 (0.34) | — | |
| SCHEMBL28528453 | 0.71 | TDP1 (0.36) | — | |
| SCHEMBL28537495 | 0.71 | ALDH1A1 (0.35) | — | |
| SCHEMBL28576813 | 0.70 | — | — | |
| SCHEMBL14570100 | 0.68 | CRBN (0.35) | — | |
| SCHEMBL28540666 | 0.68 | HTR2C (0.38) | — | |
| SCHEMBL28632312 | 0.68 | — | — |
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-112480112-B | Method for synthesizing substituted dihydrophenanthroline compound | 浙江工业大学 | 2021-10-15 | — | — | CN | disclosed |
| CN-112480112-A | Method for synthesizing substituted dihydrophenanthroline compound | 浙江工业大学 | 2021-03-12 | — | — | CN | disclosed |