⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26766993 | 0.71 | ALDH1A1 (0.45) | — | |
| SCHEMBL21954968 | 0.66 | ALDH1A1 (0.43) | — | |
| SCHEMBL22017084 | 0.64 | KMT2A (0.35) | — | |
| SCHEMBL22017506 | 0.63 | PDE2A (0.33) | — | |
| SCHEMBL26385522 | 0.59 | ALDH1A1 (0.39) | — | |
| SCHEMBL15135212 | 0.58 | ALDH1A1 (0.58) | — | |
| SCHEMBL19608614 | 0.56 | — | — | |
| SCHEMBL19764533 | 0.56 | BCHE (0.30) | — | |
| Hydrochloric Acid SCHEMBL27173500 | 0.56 | KDM4E (0.31) | — | |
| SCHEMBL26111728 | 0.56 | KDM4E (0.31) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230041518-A1 | QUINOLINE DERIVATIVES | GILEAD SCIENCES, INC. | 2023-02-09 | — | — | US | disclosed |
| US-11116760-B2 | Quinoline derivatives | GILEAD SCIENCES, INC. (US) | 2021-09-14 | — | — | US | disclosed |
| US-20200155538-A1 | QUINOLINE DERIVATIVES | GILEAD SCIENCES, INC. | 2020-05-21 | — | — | US | disclosed |