⚠ 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 | |
|---|---|---|---|---|
| Pyrimidine SCHEMBL28167288 | 0.83 | PDE4A (0.38) | — | |
| SCHEMBL8971109 | 0.78 | — | — | |
| SCHEMBL1440581 | 0.78 | — | — | |
| SCHEMBL31542578 | 0.78 | — | — | |
| SCHEMBL2120002 | 0.78 | — | — | |
| SCHEMBL2425460 | 0.74 | PDE4A (0.32) | — | |
| SCHEMBL9524365 | 0.74 | PDE4A (0.32) | — | |
| SCHEMBL8925220 | 0.74 | PDE4A (0.32) | — | |
| SCHEMBL31419892 | 0.74 | SMN1; SMN2 (0.41) | — | |
| SCHEMBL2117765 | 0.74 | SMN1; SMN2 (0.41) | — |
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 275 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119707833-A | Preparation method of 4,5, 6-trichloropyrimidine | 湖北利拓化工科技有限公司 | 2025-03-28 | — | — | CN | claimed |
| CN-116693461-A | Novel synthetic method of 4, 6-dichloro-5-methoxypyrimidine | 江苏中渊化学品有限公司 | 2023-09-05 | — | — | CN | claimed |
| CN-111440123-A | Synthetic method of 4,5, 6-trichloropyrimidine | 南京普锐达医药科技有限公司 | 2020-07-24 | — | — | CN | claimed |
| CN-106883233-B | The synthetic method of adenine and its derivative | 江苏省农用激素工程技术研究中心有限公司 | 2019-02-19 | — | — | CN | claimed |
| CN-106883233-A | The synthetic method of adenine and its derivative | 江苏省农用激素工程技术研究中心有限公司 | 2017-06-23 | — | — | CN | claimed |
| US-20130060032-A1 | POTASSIUM FLUORIDE DISPERSION AND PROCESS FOR PRODUCING FLUORINE-CONTAINING ORGANIC COMPOUND USING THE SAME | HAGIYA KOJI (JP) | 2013-03-07 | — | — | US | claimed |
| CN-102250016-B | Method for preparing 4,5,6-trichloropyrimidine | UNIV SHAOXING | 2012-11-07 | — | — | CN | claimed |
| CN-102702110-A | Preparation method of 4-amino-5, 6-dichloropyrimidine | SHENGSHI TAIKE BIOMEDICAL TECHNOLOGY SUZHOU CO LTD | 2012-10-03 | — | — | CN | claimed |
| CN-102250016-A | Method for preparing 4,5,6-trichloropyrimidine | UNIV SHAOXING | 2011-11-23 | — | — | CN | claimed |
| US-20090099387-A1 | POTASSIUM FLUORIDE DISPERSION SOLUTION, AND PROCESS FOR PRODUCTION OF FLUORINATED ORGANIC COMPOUND USING THE SAME | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2009-04-16 | — | — | US | claimed |
| EP-2011764-A1 | POTASSIUM FLUORIDE DISPERSION SOLUTION, AND PROCESS FOR PRODUCTION OF FLUORINATED ORGANIC COMPOUND USING THE SAME | Sumitomo Chemical Company, Limited (JP) | 2009-01-07 | — | — | EP | claimed |
| EP-0377905-B1 | Process for preparing 4,5,6-trichloropyrimidine | BAYER AG (DE) | 1994-02-16 | — | — | EP | claimed |
| US-5051507-A | Process for the preparation of 4,5,6-trichloropyrimidine | BAYER AKTIENGESELLSCHAFT (DE) | 1991-09-24 | — | — | US | claimed |
| JP-2233663-A | — | — | None | — | — | JP | disclosed |
| US-20250199008-A1 | COMPOSITION AND METHOD FOR DETECTION OF BIOMOLECULES VIA AROMATIC LABELING USING HETEROCYCLIC COMPOUNDS | Life Technologies Corporation (US) | 2025-06-19 | — | — | US | disclosed |
| WO-2025129105-A1 | COMPOSITION AND METHOD FOR DETECTION OF BIOMOLECULES VIA AROMATIC LABELING USING HETEROCYCLIC COMPOUNDS | Life Technologies Corporation (US) | 2025-06-19 | — | — | WO | disclosed |
| JP-H02233663-A | PREPARATION OF 4,5,6-TRICHLOROPYRIMIDINE | BAYER AG | 1990-09-17 | — | — | JP | disclosed |
| EP-0377905-A1 | Process for preparing 4,5,6-trichloropyrimidine | BAYER AG (DE) | 1990-07-18 | — | — | EP | disclosed |
| EP-0377905-A1 | Process for preparing 4,5,6-trichloropyrimidine | BAYER AG (DE) | 1990-07-18 | — | — | EP | disclosed |
| EP-0377905-A1 | Process for preparing 4,5,6-trichloropyrimidine | BAYER AG (DE) | 1990-07-18 | — | — | EP | disclosed |