⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18665762 | 1.00 | — | — | |
| SCHEMBL13687380 | 1.00 | — | — | |
| SCHEMBL16660241 | 1.00 | — | — | |
| SCHEMBL12943459 | 1.00 | — | — | |
| SCHEMBL8232415 | 1.00 | — | — | |
| SCHEMBL23906711 | 1.00 | — | — | |
| SCHEMBL8445952 | 0.72 | — | — | |
| SCHEMBL13548348 | 0.70 | — | — | |
| SCHEMBL15289260 | 0.70 | — | — | |
| SCHEMBL24621376 | 0.70 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022148317-A1 | 2-AMINOPYRIMIDINE COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF AND APPLICATION THEREOF | 广州市力鑫药业有限公司 | 2022-07-14 | — | — | WO | disclosed |
| WO-2022078305-A1 | HETEROCYCLIC DERIVATIVE AND MEDICAL APPLICATION THEREOF | 四川海思科制药有限公司 | 2022-04-21 | — | — | WO | disclosed |
| WO-2020032611-A1 | DIISOCYANATE COMPOUND HAVING ANHYDROSUGAR ALCOHOL CORE AND PREPARATION METHOD THEREFOR | 주식회사 삼양사 | 2020-02-13 | — | — | WO | disclosed |
| EP-3140300-B1 | SULFOXIMINE SUBSTITUTED QUINAZOLINES FOR PHARMACEUTICAL COMPOSITIONS | EVOTEC INT GMBH (DE) | 2019-08-14 | — | — | EP | disclosed |
| EP-2917185-B1 | SULFOXIMINE SUBSTITUTED QUINAZOLINES FOR PHARMACEUTICAL COMPOSITIONS | EVOTEC INT GMBH (DE) | 2017-05-10 | — | — | EP | disclosed |
| WO-2012010385-A1 | METHOD FOR PRODUCING DIAMINO-DIANHYDRO-DIDEOXY-HEXITOLENE, PARTICULARLY PREFERABLY 2,5-DIAMINO-1,4:3,6-DIANHYDRO-2,5-DIDEOXY-D-HEXITOL | EVONIK DEGUSSA GMBH (DE) | 2012-01-26 | — | — | WO | disclosed |