SCHEMBL6650344

SCHEMBL6650344

C[C@H]1O[C@@](F)(n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.46
GMPS P49915 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
PI4KA P42356 3/20 0.46
PI4K2B Q8TCG2 3/20 0.46
PI4K2A Q9BTU6 3/20 0.46
PI4KB Q9UBF8 3/20 0.46
AHCY P23526 9/20 0.45
PRMT5 O14744 1/20 0.44
WDR77 Q9BQA1 1/20 0.44
SLC28A1 O00337 1/20 0.44
ADORA1 P30542 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL30139991 0.85 ADORA2A (0.48) ADORA2AGMPSADORA3PI4KAPI4K2B
SCHEMBL8677295 0.85 ADORA2A (0.48) ADORA2AGMPSADORA3PI4KAPI4K2B
SCHEMBL29457186 0.83 ADORA3 (0.53) ADORA2AGMPSADORA3PI4KAPI4K2B
SCHEMBL2120940 0.83 ADORA3 (0.53) ADORA2AGMPSADORA3PI4KAPI4K2B
SCHEMBL29464979 0.83 ADORA3 (0.53) ADORA2AGMPSADORA3PI4KAPI4K2B
SCHEMBL4830361 0.82 ADORA2A (0.46) ADORA2AGMPSADORA3PI4KAPI4K2B
SCHEMBL4751168 0.82 ADORA2A (0.46) ADORA2AGMPSADORA3PI4KAPI4K2B
SCHEMBL934614 0.81 ADORA3 (0.47) ADORA2AGMPSADORA3PI4KAPI4K2B
SCHEMBL10604267 0.78 PI4KA (0.47) ADORA2AGMPSADORA3PI4KAPI4K2B
SCHEMBL10869203 0.77 PI4KA (0.49) ADORA2AGMPSADORA3PI4KAPI4K2B

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023170058-A1 METHODS AND CELLS FOR THE PRODUCTION OF FLUORINATED COMPOUNDS DANMARKS TEKNISKE UNIVERSITET (DK) 2023-09-14 WO claimed
CN-121294387-B Efficient fluoridase mutant and application thereof in synthesis of 5 '-fluoro-5' -deoxyadenosine 北京化工大学 2026-03-13 CN disclosed
CN-121294387-B Efficient fluoridase mutant and application thereof in synthesis of 5 '-fluoro-5' -deoxyadenosine 北京化工大学 2026-03-13 CN disclosed
CN-121294387-A Efficient fluoridase mutant and application thereof in synthesis of 5 '-fluoro-5' -deoxyadenosine 北京化工大学 2026-01-09 CN disclosed
CN-121294387-A Efficient fluoridase mutant and application thereof in synthesis of 5 '-fluoro-5' -deoxyadenosine 北京化工大学 2026-01-09 CN disclosed
CN-117343916-A Fluorinating enzyme mutant and application thereof in synthesis of 5' -deoxyadenosine compounds 浙江大学 2024-01-05 CN disclosed
WO-2004078914-A2 A FLUORINASE ENZYME AND USE THEREOF IN FLUORINATION SYNTHESIS THE UNIVERSITY COURT OF THE UNIVERSITY OF ST ANDREWS (GB) 2004-09-16 WO disclosed
EP-1423526-A2 AN ENZYMATIC PROCESS FOR THE SYNTHESIS OF ORGANO-FLUORINE COMPOUNDS The University Court of the University of St. Andrews (GB) 2004-06-02 EP disclosed
WO-2003020945-A2 AN ENZYMATIC PROCESS FOR THE SYNTHESIS OF ORGANO-FLUORINE COMPOUNDS THE UNIVERSITY COURT OF THE UNIVERSITY OF ST ANDREWS (GB) 2003-03-13 WO disclosed