⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4823205 | 1.00 | — | — | |
| SCHEMBL4823209 | 1.00 | — | — | |
| SCHEMBL11340649 | 0.83 | ALDH1A1 (0.32) | — | |
| SCHEMBL7038727 | 0.73 | — | — | |
| SCHEMBL4814725 | 0.73 | — | — | |
| SCHEMBL777993 | 0.73 | — | — | |
| SCHEMBL7525659 | 0.72 | ALDH1A1 (0.33) | — | |
| SCHEMBL14684341 | 0.71 | — | — | |
| SCHEMBL29262573 | 0.71 | — | — | |
| SCHEMBL4820053 | 0.69 | TSHR (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4206156-A | ANTIMICROBIAL | FUJISAWA PHARMACEUTICAL COMPANY, LIMITED (JP) | 1980-06-03 | — | — | US | disclosed |
| US-4182758-A | BACTERICIDES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1980-01-08 | — | — | US | disclosed |