⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL378762 | 0.80 | — | — | |
| SCHEMBL4432674 | 0.75 | — | — | |
| SCHEMBL11194367 | 0.75 | ALDH1A1 (0.30) | — | |
| SCHEMBL10957830 | 0.71 | ALDH1A1 (0.33) | — | |
| SCHEMBL6823381 | 0.67 | ACHE (0.31) | — | |
| SCHEMBL9295399 | 0.67 | ALDH1A1 (0.34) | — | |
| SCHEMBL4600069 | 0.67 | ALDH1A1 (0.31) | — | |
| SCHEMBL9936989 | 0.67 | ALDH1A1 (0.30) | — | |
| SCHEMBL15288773 | 0.63 | — | — | |
| SCHEMBL4279071 | 0.63 | CASP6 (0.34) | — |
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-7871982-B2 | Lincomycin derivatives and antimicrobial agents comprising the same as active ingredient | MEIJI SEIKA KAISHA, LTD. (JP) | 2011-01-18 | — | — | US | disclosed |
| US-20090156512-A1 | potent activity against resistant pneumococci | MEIJI SEIKA KAISHA, LTD. (JP) | 2009-06-18 | — | — | US | disclosed |