⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21848964 | 0.76 | — | — | |
| SCHEMBL9947125 | 0.76 | — | — | |
| SCHEMBL12527295 | 0.74 | — | — | |
| SCHEMBL14864533 | 0.74 | — | — | |
| SCHEMBL20793943 | 0.72 | — | — | |
| SCHEMBL25088485 | 0.71 | — | — | |
| SCHEMBL16846506 | 0.71 | — | — | |
| SCHEMBL18814148 | 0.70 | — | — | |
| SCHEMBL22550814 | 0.69 | — | — | |
| SCHEMBL17226899 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2269993-B1 | 2-AMINOQUINAZOLINE DERIVATIVE | KYOWA HAKKO KIRIN CO LTD (JP) | 2013-02-27 | — | — | EP | disclosed |