⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11757634 | 0.85 | ALDH1A1 (0.39) | — | |
| SCHEMBL14671465 | 0.82 | — | — | |
| SCHEMBL11758645 | 0.82 | ALDH1A1 (0.44) | — | |
| SCHEMBL11754061 | 0.79 | ALDH1A1 (0.49) | — | |
| SCHEMBL11406352 | 0.79 | ALDH1A1 (0.49) | — | |
| SCHEMBL11753980 | 0.79 | ALDH1A1 (0.49) | — | |
| SCHEMBL11758186 | 0.79 | ALDH1A1 (0.49) | — | |
| SCHEMBL11755636 | 0.79 | ALDH1A1 (0.49) | — | |
| SCHEMBL9338500 | 0.79 | ALDH1A1 (0.49) | — | |
| SCHEMBL11505448 | 0.79 | ALDH1A1 (0.49) | — |
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-4009278-A | Antimicrobial composition and method containing N-(3,5-dihalophenyl)-imide compounds | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1977-02-22 | — | — | US | disclosed |