⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25721247 | 1.00 | — | — | |
| SCHEMBL25941968 | 0.80 | — | — | |
| SCHEMBL24272770 | 0.75 | SLC18A2 (0.31) | — | |
| SCHEMBL24272938 | 0.75 | — | — | |
| SCHEMBL8320281 | 0.74 | — | — | |
| SCHEMBL24254954 | 0.71 | — | — | |
| SCHEMBL31531866 | 0.71 | — | — | |
| SCHEMBL31239836 | 0.69 | — | — | |
| SCHEMBL19614935 | 0.69 | POLB (0.33) | — | |
| SCHEMBL28511151 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20220081413-A1 | SYNTHESIS OF QUINAZOLINE COMPOUNDS | GENENTECH, INC. (US) | 2022-03-17 | — | — | US | disclosed |
| WO-2022035790-A1 | SYNTHESIS OF QUINAZOLINE COMPOUNDS | GENENTECH, INC. (US) | 2022-02-17 | — | — | WO | disclosed |