⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14048880 | 0.82 | NR1I2 (0.37) | — | |
| SCHEMBL14049050 | 0.82 | NR1I2 (0.37) | — | |
| SCHEMBL5117081 | 0.82 | NR1I2 (0.37) | — | |
| SCHEMBL331086 | 0.82 | NR1I2 (0.37) | — | |
| SCHEMBL4980179 | 0.82 | NR1I2 (0.37) | — | |
| SCHEMBL4980169 | 0.82 | NR1I2 (0.37) | — | |
| SCHEMBL7668284 | 0.82 | NR1I2 (0.37) | — | |
| SCHEMBL5995044 | 0.79 | RAB9A (0.39) | — | |
| SCHEMBL7248979 | 0.79 | RAB9A (0.39) | — | |
| SCHEMBL30166490 | 0.79 | RAB9A (0.39) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6870053-B2 | Chloropyrimidine intermediates | SMITHKLINE BEECHAM CORPORATION (US) | 2005-03-22 | — | — | US | disclosed |
| US-6555687-B1 | N,N'-(4,6-dichloro-2,5-pyrimidinediyl)bisformamide as a chemical intermediate for 9-substituted-2-aminopurines, such as famciclovir and penciclovir; viricides; HIV and hepatitus virus | SMITHKLINE BEECHAM CORPORATION | 2003-04-29 | — | — | US | disclosed |
| US-6552193-B1 | N-(2-Amino-4,6-dichloro-5-pyrimidinyl)formamide | SMITHKLINE BEECHAM CORPORATION | 2003-04-22 | — | — | US | disclosed |
| US-20020173649-A1 | Chloropvrimidine intermediates | SMITHKLINE BEECHAM CORPORATION | 2002-11-21 | — | — | US | disclosed |
| US-6448403-B1 | DEHALOGENATION AND AMINATION TO SYNTHESIZE SUCH AS 4-((2-AMINO-6-CHLORO-5-FORMAMIDO-4-PYRIMIDINYL)AMINO)-2-CYCLOPENTENE-1 -METHANOL; CHEMICAL INTERMEDIATES FOR PURINE NUCLEOSIDE ANALOGUES | SMITHKLINE BEECHAM CORPORATION | 2002-09-10 | — | — | US | disclosed |
| US-6087501-A | Chloropyrimidine intermediates and processes for their preparation | GLAXO WELLCOME INC. (US) | 2000-07-11 | — | — | US | disclosed |
| EP-0741710-B1 | CHLOROPYRIMIDINE INTERMEDIATES | WELLCOME FOUND (GB) | 2000-05-10 | — | — | EP | disclosed |
| US-5917041-A | Chloropyrimidine intermediates | GLAXO WELLCOME INC. (US) | 1999-06-29 | — | — | US | disclosed |
| US-5917042-A | Process for the preparation of 2,5-diamino-4,6-dichloropyrimidine | GLAXO WELLCOME INC. (US) | 1999-06-29 | — | — | US | disclosed |