SCHEMBL28115748

SCHEMBL28115748

CC(O)Cn1cnc2ncnc(N)c21

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 7/20 0.64
ADORA1 P30542 4/20 0.60
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
EGFR P00533 1/20 0.43
SRC P12931 1/20 0.43
KDR P35968 1/20 0.43
TEK Q02763 1/20 0.43
ADORA2B P29275 1/20 0.43
AHCY P23526 2/20 0.41
PIK3CD O00329 2/20 0.40
ALDH1A1 P00352 1/20 0.40
DNMT3A Q9Y6K1 1/20 0.37
PI4KA P42356 1/20 0.37
PI4K2B Q8TCG2 1/20 0.37
PI4K2A Q9BTU6 1/20 0.37
PI4KB Q9UBF8 1/20 0.37
CYP3A4 P08684 1/20 0.37
ADA P00813 1/20 0.36

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
SCHEMBL1665301 0.78 ADORA2A (0.69) ADORA2AADORA1EGFRSRCKDR
SCHEMBL5801729 0.78 ADORA2A (1.00) ADORA2AADORA1EGFRSRCKDR
SCHEMBL11611616 0.77 ADORA2A (0.51) ADORA2AADORA1LMNAEGFRSRC
SCHEMBL1665392 0.76 ADORA2A (0.71) ADORA2AADORA1EGFRSRCKDR
SCHEMBL4815868 0.76 ADORA2A (0.75) ADORA2AADORA1LMNASMN1; SMN2ADORA2B
SCHEMBL4815870 0.76 ADORA2A (0.71) ADORA2AADORA1LMNAEGFRSRC
SCHEMBL5810639 0.75 ADORA2A (1.00) ADORA2AADORA1ADORA2BAHCYALDH1A1
SCHEMBL29496348 0.75 ADORA2A (1.00) ADORA2AADORA1ADORA2BAHCYALDH1A1
SCHEMBL1393316 0.75 ADORA2A (1.00) ADORA2AADORA1ADORA2BAHCYALDH1A1
SCHEMBL904363 0.75 ADORA2A (1.00) ADORA2AADORA1ADORA2BAHCYALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108358968-B Preparation method of tenofovir 科兴生物制药股份有限公司 2020-09-15 CN disclosed
CN-108358968-A A kind of preparation method of high-purity tenofovir 山东科兴生物制品有限公司 2018-08-03 CN disclosed
CN-104230934-B A kind of compound and its production and use 上海医药工业研究院 2016-12-28 CN disclosed