⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7713853 | 1.00 | — | — | |
| SCHEMBL7345262 | 0.75 | TDP1 (0.52) | — | |
| SCHEMBL7345258 | 0.75 | TDP1 (0.52) | — | |
| Chloromethane SCHEMBL8972585 | 0.74 | TDP1 (0.58) | — | |
| SCHEMBL25246733 | 0.73 | — | — | |
| SCHEMBL951880 | 0.73 | — | — | |
| SCHEMBL15043324 | 0.73 | — | — | |
| SCHEMBL263813 | 0.73 | — | — | |
| SCHEMBL1430406 | 0.73 | — | — | |
| SCHEMBL951882 | 0.73 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114853739-B | Acetylenic pyrazine FGFR inhibitor and preparation method and application thereof | 药雅科技(上海)有限公司 | 2023-09-22 | — | — | CN | disclosed |
| CN-115043832-B | FGFR inhibitor acetylenic heterocyclic compound and preparation method and application thereof | 药雅科技(上海)有限公司 | 2023-08-22 | — | — | CN | disclosed |
| US-20230159436-A1 | APPLICATIONS OF AMIDE ANALOGS OF TRITERPENES IN CURES OF CANCER AND OTHER DISEASES | PACIFIC ARROW LTD (CN) | 2023-05-25 | — | — | US | disclosed |
| CN-115043832-A | FGFR inhibitor alkyne-substituted heterocyclic compound and preparation method and application thereof | 药雅科技(上海)有限公司 | 2022-09-13 | — | — | CN | disclosed |
| CN-114853739-A | Alkynyl pyrazine FGFR inhibitor and preparation method and application thereof | 药雅科技(上海)有限公司 | 2022-08-05 | — | — | CN | disclosed |
| CN-112939982-A | Alkyne heterocyclic BTK inhibitor and preparation method and application thereof | 药雅科技(上海)有限公司 | 2021-06-11 | — | — | CN | disclosed |
| US-6372913-B1 | REACTING HALOGENOMALONALDEHYDE WITH THIOCARBAMATE OR DITHIOCARBAMATE IN PRESENCE OF SOLVENT, WHEREIN REACTION MIXTURE COMPRISES LESS THAN 5% BY WEIGHT, BASED ON TOTAL WEIGHT OF SOLVENT, OF WATER | BAYER AG (DE) | 2002-04-16 | — | — | US | disclosed |
| EP-0896962-A1 | Process for the preparation of 2-substituted-5-formylthiazoles | BAYER AG (DE) | 1999-02-17 | — | — | EP | disclosed |
| EP-0873324-A1 | IMPROVED PROCESS FOR PRODUCING 5-FORMYLTHIAZOL | BAYER AG (DE) | 1998-10-28 | — | — | EP | disclosed |
| WO-1997022599-A1 | IMPROVED PROCESS FOR PRODUCING 5-FORMYLTHIAZOL | BAYER AKTIENGESELLSCHAFT (DE) | 1997-06-26 | — | — | WO | disclosed |