⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10404084 | 0.70 | F2 (0.39) | — | |
| SCHEMBL8770491 | 0.69 | — | — | |
| SCHEMBL11767701 | 0.68 | ALDH1A1 (0.46) | — | |
| Dimethylamine SCHEMBL10414200 | 0.68 | CA1 (0.40) | — | |
| SCHEMBL11786548 | 0.67 | — | — | |
| SCHEMBL18053059 | 0.67 | NPC1 (0.36) | — | |
| Ethane SCHEMBL11235949 | 0.65 | — | — | |
| SCHEMBL19435 | 0.64 | — | — | |
| SCHEMBL8770944 | 0.64 | — | — | |
| SCHEMBL10403239 | 0.62 | F2 (0.39) | — |
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-6150351-A | ADMINISTERING AN EFFECTIVE AMOUNT OF THE CEPHEM COMPOUND TO A PATIENT SUFFERING FROM DISEASES CAUSED BY HELICOBACTER PYLORI | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2000-11-21 | — | — | US | disclosed |