⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4019377 | 0.86 | DPP4 (0.33) | — | |
| Sulfamide SCHEMBL6017402 | 0.78 | LMNA (0.33) | — | |
| SCHEMBL8926767 | 0.73 | — | — | |
| SCHEMBL7166980 | 0.73 | — | — | |
| SCHEMBL28177841 | 0.72 | KCNH2 (0.33) | — | |
| Hydrochloric Acid SCHEMBL2773491 | 0.71 | — | — | |
| SCHEMBL4513406 | 0.70 | — | — | |
| SCHEMBL6644860 | 0.70 | DPP4 (0.31) | — | |
| SCHEMBL8326317 | 0.70 | — | — | |
| SCHEMBL8326319 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0659178-A4 | CHIRAL QUINOLONE INTERMEDIATES. | ABBOTT LAB (US) | 1996-03-27 | — | — | EP | disclosed |
| EP-0659178-A1 | CHIRAL QUINOLONE INTERMEDIATES | ABBOTT LABORATORIES (US) | 1995-06-28 | — | — | EP | disclosed |
| WO-1994006766-A1 | CHIRAL QUINOLONE INTERMEDIATES | ABBOTT LABORATORIES (US) | 1994-03-31 | — | — | WO | disclosed |
| US-5252747-A | Chiral quinolone intermediates | ABBOTT LABORATORIES (US) | 1993-10-12 | — | — | US | disclosed |