⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL737055 | 0.91 | CHRM2 (0.40) | — | |
| SCHEMBL737772 | 0.87 | — | — | |
| SCHEMBL736535 | 0.87 | CHRM2 (0.36) | — | |
| SCHEMBL2099507 | 0.69 | HRH3 (0.37) | — | |
| SCHEMBL736668 | 0.63 | — | — | |
| SCHEMBL736054 | 0.63 | CHRM2 (0.33) | — | |
| SCHEMBL14454559 | 0.60 | CHRM2 (0.36) | — | |
| SCHEMBL24578964 | 0.58 | CHRM2 (0.35) | — | |
| SCHEMBL5731686 | 0.58 | CHRM2 (0.40) | — | |
| SCHEMBL4541906 | 0.58 | CHRM2 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9556191-B2 | Aminoquinazoline derivatives and their salts and methods of use thereof | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2017-01-31 | — | — | US | disclosed |
| US-20160039838-A1 | AMINOQUINAZOLINE DERIVATIVES AND THEIR SALTS AND METHODS OF USE THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2016-02-11 | — | — | US | disclosed |
| WO-2014177038-A1 | AMINOQUINAZOLINE DERIVATIVES AND THEIR SALTS AND METHODS OF USE THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2014-11-06 | — | — | WO | disclosed |