⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12154534 | 1.00 | — | — | |
| SCHEMBL10036450 | 0.83 | — | — | |
| SCHEMBL14074203 | 0.83 | APLNR (0.32) | — | |
| SCHEMBL25034938 | 0.82 | — | — | |
| SCHEMBL12086504 | 0.82 | — | — | |
| SCHEMBL23773079 | 0.80 | ALDH1A1 (0.33) | — | |
| SCHEMBL16573367 | 0.77 | KDM4E (0.41) | — | |
| SCHEMBL11880972 | 0.73 | — | — | |
| SCHEMBL6817138 | 0.71 | — | — | |
| SCHEMBL11469288 | 0.71 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2014095774-A1 | BET-PROTEIN-INHIBITING DIHYDROPYRIDOPYRAZINONES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2014-06-26 | — | — | WO | disclosed |
| EP-1797111-B1 | ACYLSULFONAMIDE COMPOUNDS AS INHIBITORS OF HEPATITIS C VIRUS NS3 SERINE PROTEASE | SCHERING CORP (US) | 2011-06-22 | — | — | EP | disclosed |
| EP-1383731-B1 | BIARYL COMPOUNDS AS SERINE PROTEASE INHIBITORS | BIOCRYST PHARM INC (US) | 2009-08-05 | — | — | EP | disclosed |
| EP-0819000-B1 | NODULISPORIC ACID DERIVATIVES | MERCK & CO INC (US) | 2009-07-08 | — | — | EP | disclosed |
| EP-0700460-A1 | FILTERING PARTICULATE CELLULOSIC-BASED MATERIAL | COURTAULDS FIBRES HOLDINGS LTD (GB) | 1996-03-13 | — | — | EP | disclosed |
| WO-1994028215-A1 | FILTERING PARTICULATE CELLULOSIC-BASED MATERIAL | COURTAULDS FIBRES (HOLDINGS) LIMITED (GB) | 1994-12-08 | — | — | WO | disclosed |