⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL812575 | 0.82 | — | — | |
| SCHEMBL6984505 | 0.78 | — | — | |
| SCHEMBL8577723 | 0.76 | — | — | |
| SCHEMBL18334654 | 0.75 | — | — | |
| SCHEMBL28997121 | 0.75 | — | — | |
| SCHEMBL10288614 | 0.75 | — | — | |
| SCHEMBL9073650 | 0.75 | — | — | |
| SCHEMBL28629176 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL30881387 | 0.74 | HSD11B1 (0.31) | — | |
| SCHEMBL12500608 | 0.73 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107011193-B | Method for preparing N-methyl p-anisidine | 中国科学院兰州化学物理研究所 | 2020-05-26 | — | — | CN | disclosed |
| WO-2009091388-A2 | TRIAZINES AND RELATED COMPOUNDS HAVING ANTIVIRAL ACTIVITY, COMPOSITIONS AND METHODS THEREOF | PROGENICS PHARMACEUTICALS, INC. (US) | 2009-07-23 | — | — | WO | disclosed |
| EP-1654261-A1 | HEPATITIS C INHIBITOR COMPOUNDS | Boehringer Ingelheim International GmbH (DE) | 2006-05-10 | — | — | EP | disclosed |
| WO-2004103996-A1 | HEPATITIS C INHIBITOR COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2004-12-02 | — | — | WO | disclosed |