⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10743150 | 0.82 | — | — | |
| SCHEMBL10745422 | 0.77 | — | — | |
| SCHEMBL376361 | 0.73 | CYP1A2 (0.31) | — | |
| SCHEMBL2116132 | 0.73 | — | — | |
| SCHEMBL10711472 | 0.71 | ALDH1A1 (0.44) | — | |
| SCHEMBL10973218 | 0.71 | — | — | |
| SCHEMBL9810085 | 0.71 | — | — | |
| SCHEMBL9721075 | 0.69 | — | — | |
| SCHEMBL10745018 | 0.68 | — | — | |
| SCHEMBL10744062 | 0.67 | CYP3A4 (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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0240766-A2 | Process for the preparation of tetrachloropyrimidine | BAYER AG (DE) | 1987-10-14 | — | — | EP | claimed |
| EP-0183092-A1 | 5,6-Dichloro-4-hydroxy-2-trichloromethylpyrimidine | BAYER AG (DE) | 1986-06-04 | — | — | EP | claimed |
| EP-0173191-A2 | 5,5-Dichloro-4,5-dihydro-6-hydroxy-2-trichloromethyl-pyrimidin-4-on, process for its preparation and its use | BAYER AG (DE) | 1986-03-05 | — | — | EP | claimed |
| CN-101646657-B | Process for producing trichloropyrimidine compound | SUMITOMO CHEMICAL CO JP | 2012-08-08 | — | — | CN | disclosed |
| US-8158787-B2 | Process for producing trichloropyrimidine compound | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-04-17 | — | — | US | 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 |
| EP-0127827-B1 | PROCESS FOR PREPARING CHLOROPYRIMIDINES | BAYER AG (DE) | 1990-01-24 | — | — | EP | disclosed |
| EP-0240766-A3 | PROCESS FOR THE PREPARATION OF TETRACHLOROPYRIMIDINE | BAYER AG (DE) | 1988-03-23 | — | — | EP | disclosed |
| EP-0240766-A2 | Process for the preparation of tetrachloropyrimidine | BAYER AG (DE) | 1987-10-14 | — | — | EP | disclosed |
| US-4668788-A | 5,5-dichloro-4,5-dihydro-6-hydroxy-2-trichloromethylpyrimidin-4-one | BAYER AKTIENGESELLSCHAFT (DE) | 1987-05-26 | — | — | US | disclosed |
| EP-0173191-A3 | 5,5-DICHLORO-4,5-DIHYDRO-6-HYDROXY-2-TRICHLOROMETHYL-PYRIMIDIN-4-ON, PROCESS FOR ITS PREPARATION AND ITS USE | BAYER AG (DE) | 1987-04-01 | — | — | EP | disclosed |
| EP-0125650-B1 | REACTIVE DYES, PROCESS FOR THEIR PREPARATION AND THEIR USE IN THE DYEING AND PRINTING OF SUBSTRATES | BAYER AG (DE) | 1987-04-01 | — | — | EP | disclosed |
| EP-0183092-A1 | 5,6-Dichloro-4-hydroxy-2-trichloromethylpyrimidine | BAYER AG (DE) | 1986-06-04 | — | — | EP | disclosed |
| EP-0182190-A2 | Process for the preparation of 2,4-dihydroxypyrimidines | BAYER AG (DE) | 1986-05-28 | — | — | EP | disclosed |
| EP-0173191-A2 | 5,5-Dichloro-4,5-dihydro-6-hydroxy-2-trichloromethyl-pyrimidin-4-on, process for its preparation and its use | BAYER AG (DE) | 1986-03-05 | — | — | EP | disclosed |
| EP-0173191-A2 | 5,5-Dichloro-4,5-dihydro-6-hydroxy-2-trichloromethyl-pyrimidin-4-on, process for its preparation and its use | BAYER AG (DE) | 1986-03-05 | — | — | EP | disclosed |
| EP-0139248-A2 | Reactive dyes | BAYER AG (DE) | 1985-05-02 | — | — | EP | disclosed |
| EP-0127827-A2 | Process for preparing chloropyrimidines | BAYER AG (DE) | 1984-12-12 | — | — | EP | disclosed |
| EP-0125650-A2 | Reactive dyes, process for their preparation and their use in the dyeing and printing of substrates | BAYER AG (DE) | 1984-11-21 | — | — | EP | disclosed |