⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28760081 | 0.87 | TSHR (0.30) | — | |
| SCHEMBL18508048 | 0.83 | — | — | |
| SCHEMBL18652870 | 0.81 | — | — | |
| SCHEMBL18508060 | 0.81 | — | — | |
| SCHEMBL18958979 | 0.79 | — | — | |
| SCHEMBL18958980 | 0.79 | — | — | |
| SCHEMBL18508049 | 0.79 | DNM1 (0.31) | — | |
| SCHEMBL18958981 | 0.79 | — | — | |
| SCHEMBL18508042 | 0.78 | PLA2G1B (0.33) | — | |
| SCHEMBL10136491 | 0.78 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4223761-A1 | QUINAZOLINE COMPOUND AND APPLICATION THEREOF | Shanghai Pharmaceuticals Holding Co., Ltd. (CN) | 2023-08-09 | — | — | EP | disclosed |
| US-9994593-B2 | Copper compound, starting material for forming thin film, and method for manufacturing thin film | ADEKA CORPORATION (JP) | 2018-06-12 | — | — | US | disclosed |
| US-20170044188-A1 | COPPER COMPOUND, STARTING MATERIAL FOR FORMING THIN FILM, AND METHOD FOR MANUFACTURING THIN FILM | ADEKA CORPORATION (JP) | 2017-02-16 | — | — | US | disclosed |
| WO-2011114275-A1 | SPIROCYCLIC COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS AND DIAGNOSTIC PROBES | UNIVERSITY OF BASEL (CH) | 2011-09-22 | — | — | WO | disclosed |