⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL169069 | 0.70 | — | — | |
| SCHEMBL476567 | 0.69 | — | — | |
| SCHEMBL248516 | 0.61 | — | — | |
| SCHEMBL8836019 | 0.59 | — | — | |
| SCHEMBL25401 | 0.59 | — | — | |
| SCHEMBL5439 | 0.59 | — | — | |
| SCHEMBL1089961 | 0.59 | — | — | |
| SCHEMBL250016 | 0.58 | — | — | |
| SCHEMBL116416 | 0.58 | — | — | |
| SCHEMBL21840732 | 0.58 | KDM4E (0.32) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1648862-A2 | SUBSTITUTED ARYLTHIOUREA DERIVATIVES USEFUL AS INHIBITORS OF VIRAL REPLICATION | Achillion Pharmaceuticals, Inc. (US) | 2006-04-26 | — | — | EP | disclosed |
| WO-2005007601-A2 | SUBSTITUTED ARYLTHIOUREA DERIVATIVES USEFUL AS INHIBITORS OF VIRAL REPLICATION | ACHILLION PHARMACEUTICALS, INC. (US) | 2005-01-27 | — | — | WO | disclosed |
| US-20030236369-A1 | Transparent fluorine-containing copolymer | CENTRAL GLASS COMPANY, LIMITED (JP) | 2003-12-25 | — | — | US | disclosed |