⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17130311 | 1.00 | — | — | |
| SCHEMBL15605954 | 0.87 | — | — | |
| SCHEMBL17130412 | 0.86 | — | — | |
| SCHEMBL17131380 | 0.86 | — | — | |
| SCHEMBL15259018 | 0.78 | — | — | |
| SCHEMBL18359792 | 0.78 | — | — | |
| SCHEMBL10142421 | 0.76 | — | — | |
| SCHEMBL10143786 | 0.76 | — | — | |
| SCHEMBL17130321 | 0.76 | GJB2 (0.30) | — | |
| SCHEMBL15606972 | 0.74 | — | — |
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-9777035-B2 | 4′-substituted nucleoside reverse transcriptase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2017-10-03 | — | — | US | disclosed |
| US-20150274767-A1 | 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2015-10-01 | — | — | US | disclosed |