⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4924571 | 0.89 | CYP19A1 (0.41) | — | |
| SCHEMBL28450545 | 0.86 | SOAT1 (0.42) | — | |
| SCHEMBL4618500 | 0.82 | — | — | |
| SCHEMBL9823661 | 0.78 | — | — | |
| SCHEMBL9499137 | 0.76 | SOAT1 (0.31) | — | |
| SCHEMBL3625692 | 0.73 | — | — | |
| SCHEMBL4269009 | 0.72 | NPC1 (0.45) | — | |
| SCHEMBL7991058 | 0.70 | — | — | |
| SCHEMBL578121 | 0.69 | — | — | |
| SCHEMBL4766906 | 0.69 | CYP19A1 (0.49) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109730072-A | A kind of bactericidal composition and its application | 山东康乔生物科技有限公司 | 2019-05-10 | — | — | CN | disclosed |
| US-20080200475-A1 | 4-Piperazinothieno[2,3-D] Pyrimidine Compounds As Platelet Aggregation Inhibitors | PFIZER INC. | 2008-08-21 | — | — | US | disclosed |
| EP-1866317-A1 | 4-PIPERAZINOTHIENO [2, 3-D] PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS | Pharmacia & Upjohn Company LLC (US) | 2007-12-19 | — | — | EP | disclosed |
| WO-2006103555-A1 | 4-PIPERAZINOTHIENO [2, 3-D] PYRIMIDINE COMPOUNDS AS PLATELET AGGREGATION INHIBITORS | PHARMACIA & UPJOHN COMPANY LLC (US) | 2006-10-05 | — | — | WO | disclosed |