⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31542578 | 0.85 | — | — | |
| SCHEMBL2120002 | 0.85 | — | — | |
| SCHEMBL6719975 | 0.81 | — | — | |
| SCHEMBL8718664 | 0.77 | SELE (0.32) | — | |
| SCHEMBL30828905 | 0.77 | SELE (0.32) | — | |
| SCHEMBL11525732 | 0.75 | — | — | |
| SCHEMBL31462905 | 0.75 | — | — | |
| SCHEMBL13472456 | 0.75 | KMO (0.44) | — | |
| SCHEMBL6718492 | 0.75 | GABRA1 (0.31) | — | |
| SCHEMBL10899348 | 0.74 | ACACB (0.31) | — |
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 12 patents. 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-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-102702110-A | Preparation method of 4-amino-5, 6-dichloropyrimidine | SHENGSHI TAIKE BIOMEDICAL TECHNOLOGY SUZHOU CO LTD | 2012-10-03 | — | — | CN | claimed |
| 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 | disclosed |
| 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 | disclosed |
| 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 | disclosed |
| 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 | disclosed |
| CN-102702110-A | Preparation method of 4-amino-5, 6-dichloropyrimidine | SHENGSHI TAIKE BIOMEDICAL TECHNOLOGY SUZHOU CO LTD | 2012-10-03 | — | — | CN | disclosed |
| US-8158787-B2 | Process for producing trichloropyrimidine compound | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-04-17 | — | — | US | disclosed |
| CN-102250016-A | Method for preparing 4,5,6-trichloropyrimidine | UNIV SHAOXING | 2011-11-23 | — | — | CN | disclosed |
| US-20100160630-A1 | PROCESS FOR PRODUCING TRICHLOROPYRIMIDINE COMPOUND | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-06-24 | — | — | US | disclosed |
| EP-2128141-A1 | PROCESS FOR PRODUCING TRICHLOROPYRIMIDINE COMPOUND | Sumitomo Chemical Company, Limited (JP) | 2009-12-02 | — | — | EP | disclosed |