⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17874612 | 1.00 | — | — | |
| SCHEMBL17461994 | 1.00 | — | — | |
| SCHEMBL17147880 | 1.00 | — | — | |
| SCHEMBL768043 | 1.00 | — | — | |
| SCHEMBL14790170 | 1.00 | — | — | |
| SCHEMBL17461992 | 0.82 | LMNA (0.33) | — | |
| SCHEMBL19321517 | 0.82 | LMNA (0.33) | — | |
| SCHEMBL13696846 | 0.82 | — | — | |
| SCHEMBL784380 | 0.82 | — | — | |
| SCHEMBL13250650 | 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 |
|---|---|---|---|---|---|---|---|
| US-20170253584-A1 | PREPARATION OF 2'-FLUORO-2'-ALKYL-SUBSTITUTED OR OTHER OPTIONALLY SUBSTITUTED RIBOFURANOSYL PYRIMIDINES AND PURINES AND THEIR DERIVATIVES | GILEAD PHARMASSET LLC (US) | 2017-09-07 | — | — | US | disclosed |
| US-20160024061-A1 | PREPARATION OF 2'-FLUORO-2'-ALKYL-SUBSTITUTED OR OTHER OPTIONALLY SUBSTITUTED RIBOFURANOSYL PYRIMIDINES AND PURINES AND THEIR DERIVATIVES | PHARMASSET, INC. | 2016-01-28 | — | — | US | disclosed |