⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4892169 | 0.72 | — | — | |
| SCHEMBL28873449 | 0.71 | — | — | |
| SCHEMBL2098624 | 0.69 | — | — | |
| SCHEMBL297953 | 0.65 | — | — | |
| SCHEMBL1396031 | 0.65 | — | — | |
| SCHEMBL27674363 | 0.62 | ALDH1A1 (0.31) | — | |
| SCHEMBL11022133 | 0.62 | — | — | |
| SCHEMBL4389113 | 0.62 | — | — | |
| SCHEMBL10718003 | 0.62 | — | — | |
| SCHEMBL30110262 | 0.62 | — | — |
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-103582420-B | 2 '-substituted nucleoside derivates and the method using its treatment virosis | 默沙东公司 | 2016-10-19 | — | — | CN | disclosed |
| CN-103582420-A | 2'-substituted nucleoside derivatives and methods of use thereof for the treatment of viral diseases | MERCK SHARP & DOHME (US) | 2014-02-12 | — | — | CN | disclosed |