⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29091844 | 0.89 | CETP (0.30) | — | |
| SCHEMBL21525730 | 0.87 | LMNA (0.30) | — | |
| SCHEMBL28850985 | 0.86 | — | — | |
| SCHEMBL7626309 | 0.85 | — | — | |
| SCHEMBL1568375 | 0.85 | — | — | |
| SCHEMBL8163819 | 0.85 | — | — | |
| SCHEMBL2409745 | 0.85 | — | — | |
| SCHEMBL9128134 | 0.85 | — | — | |
| SCHEMBL11045956 | 0.82 | — | — | |
| SCHEMBL5482398 | 0.82 | — | — |
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-114845708-A | Compounds for treating bacterial infections and enhancing antibiotics | 乔治亚州大学研究基金会 | 2022-08-02 | — | — | CN | disclosed |
| CN-112566631-A | Amidines and amidine analogs for the treatment of bacterial infections and potentiation of antibiotics | 乔治亚州大学研究基金会 | 2021-03-26 | — | — | CN | disclosed |