⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2601688 | 0.61 | — | — | |
| SCHEMBL735080 | 0.60 | — | — | |
| SCHEMBL16660165 | 0.57 | — | — | |
| SCHEMBL133474 | 0.56 | GSK3A (0.39) | — | |
| SCHEMBL2206771 | 0.54 | — | — | |
| SCHEMBL6850987 | 0.54 | GSK3A (0.44) | — | |
| SCHEMBL4409585 | 0.53 | GSK3A (0.32) | — | |
| SCHEMBL10483659 | 0.53 | — | — | |
| SCHEMBL14965051 | 0.53 | — | — | |
| SCHEMBL530530 | 0.52 | CASP3 (0.40) | — |
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-109890793-B | Novel anthelmintic quinoline-3-carboxamide derivatives | 拜耳动物保健有限责任公司 | 2022-11-18 | — | — | CN | disclosed |
| CN-114423749-A | Isoquinoline derivatives and their use for the treatment of parasitic infections | 拜耳动物保健有限责任公司 | 2022-04-29 | — | — | CN | disclosed |
| EP-3538512-A1 | NEW ANTHELMINTIC QUINOLINE-3-CARBOXAMIDE DERIVATIVES | Bayer Animal Health GmbH (DE) | 2019-09-18 | — | — | EP | disclosed |
| WO-2018087036-A1 | NEW ANTHELMINTIC QUINOLINE-3-CARBOXAMIDE DERIVATIVES | BAYER ANIMAL HEALTH GMBH (DE) | 2018-05-17 | — | — | WO | disclosed |