⚠ 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL2206426 | 0.97 | IDO1 (0.52) | — | |
| Hydrochloric Acid SCHEMBL1452911 | 0.97 | IDO1 (0.52) | — | |
| SCHEMBL11444864 | 0.89 | IDO1 (0.46) | — | |
| SCHEMBL11288839 | 0.76 | CYP1A2 (0.68) | — | |
| SCHEMBL1149394 | 0.76 | IDO1 (0.58) | — | |
| SCHEMBL11410252 | 0.76 | IDO1 (0.58) | — | |
| SCHEMBL143961 | 0.76 | CYP1A2 (0.68) | — | |
| P-Xylene SCHEMBL28187926 | 0.73 | IDO1 (0.55) | — | |
| SCHEMBL5497395 | 0.73 | IDO1 (0.55) | — | |
| SCHEMBL40574 | 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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108884070-B | Pyridyl derivatives as bromodomain inhibitors | 葛兰素史克知识产权第二有限公司 | 2021-07-02 | — | — | CN | disclosed |
| EP-1313707-B1 | QUINOLINE DERIVATIVES AS ANTI-INFLAMMATION AGENTS | HOFFMANN LA ROCHE (CH) | 2007-07-18 | — | — | EP | disclosed |
| US-7186840-B2 | Quinoline derivatives as anti-inflammatory agents | ROCHE PALO ALTO LLC (US) | 2007-03-06 | — | — | US | disclosed |
| US-7049325-B2 | Quinoline derivatives as anti-inflammatory agents | SYNTEX (U.S.A.) LLC (US) | 2006-05-23 | — | — | US | disclosed |
| US-20060084677-A1 | Quinoline derivatives as anti-inflammatory agents | BROKA CHRIS A | 2006-04-20 | — | — | US | disclosed |
| CN-1199950-C | Quinolene derivatives as anti-inflammation agents | HOFFMANN LA ROCHE (CH) | 2005-05-04 | — | — | CN | disclosed |
| CN-1466575-A | Quinoline derivatives as anti-inflammatory agents | - | 2004-01-07 | — | — | CN | disclosed |
| EP-1313707-A1 | QUINOLINE DERIVATIVES AS ANTI-INFLAMMATION AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 2003-05-28 | — | — | EP | disclosed |
| US-20020082276-A1 | Quinoline derivatives as anti-inflammatory agents | SNYTEX (U.S.A.) LLC | 2002-06-27 | — | — | US | disclosed |
| WO-2002012192-A1 | QUINOLENE DERIVATIVES AS ANTI-INFLAMMATION AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 2002-02-14 | — | — | WO | disclosed |