⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3101164 | 0.78 | — | — | |
| SCHEMBL14506018 | 0.78 | — | — | |
| SCHEMBL27789557 | 0.75 | — | — | |
| SCHEMBL1050160 | 0.72 | — | — | |
| SCHEMBL6649079 | 0.71 | — | — | |
| SCHEMBL14506020 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL28119660 | 0.70 | — | — | |
| SCHEMBL4302730 | 0.69 | — | — | |
| SCHEMBL27499692 | 0.68 | — | — | |
| Biphenyl SCHEMBL27408392 | 0.66 | ALDH1A1 (0.39) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3601284-A1 | NAPHTHYRIDINES AS INHIBITORS OF HPK1 | H. Hoffnabb-La Roche Ag (CH) | 2020-02-05 | — | — | EP | disclosed |
| WO-2018183956-A1 | NAPHTHYRIDINES AS INHIBITORS OF HPK1 | GENENTECH, INC. (US) | 2018-10-04 | — | — | WO | disclosed |