⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28661914 | 1.00 | — | — | |
| SCHEMBL4053876 | 0.72 | — | — | |
| SCHEMBL4724702 | 0.70 | — | — | |
| SCHEMBL4055577 | 0.65 | — | — | |
| SCHEMBL24810607 | 0.62 | — | — | |
| SCHEMBL29239439 | 0.62 | — | — | |
| SCHEMBL24810605 | 0.62 | — | — | |
| SCHEMBL4050882 | 0.61 | — | — | |
| SCHEMBL7734404 | 0.61 | — | — | |
| SCHEMBL9344956 | 0.60 | ATM (0.37) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113735838-B | Dihydropyrimidine compound, preparation method and application thereof | 成都施贝康生物医药科技有限公司 | 2022-07-08 | — | — | CN | disclosed |
| CN-113735838-A | Dihydropyrimidine compound, preparation method and application thereof | 成都施贝康生物医药科技有限公司 | 2021-12-03 | — | — | CN | disclosed |
| US-7569570-B2 | Thienopyrimidines, process for preparing the same and use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-08-04 | — | — | US | disclosed |
| US-7569570-B2 | Thienopyrimidines, process for preparing the same and use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-08-04 | — | — | US | disclosed |
| US-7569570-B2 | Thienopyrimidines, process for preparing the same and use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-08-04 | — | — | US | disclosed |
| US-20050222174-A1 | Thienopyrimidines, process for preparing the same and use thereof | TAKEDA CHEMICAL INDUSTRIES LTD. (JP) | 2005-10-06 | — | — | US | disclosed |
| EP-1479684-A1 | THIENOPYRIMIDINES, PROCESS FOR PREPARING THE SAME AND USE THEREOF | Takeda Chemical Industries, Ltd. (JP) | 2004-11-24 | — | — | EP | disclosed |