SCHEMBL8228339

SCHEMBL8228339

Cn1ncc(-c2ccnc(NC3CCOC3)n2)c1N

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 9/20 0.50
PIK3C3 Q8NEB9 2/20 0.47
MKNK2 Q9HBH9 7/20 0.46
CDK4 P11802 4/20 0.46
GSK3B P49841 4/20 0.46
CDK2 P24941 1/20 0.46
RET P07949 1/20 0.45
MAPK1 P28482 2/20 0.45
MAPK8 P45983 2/20 0.45
MAPK9 P45984 2/20 0.45
MAPK10 P53779 2/20 0.45
PIK3CD O00329 1/20 0.43

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
SCHEMBL8229238 0.94 MAPK8 (0.52) MKNK1PIK3C3MKNK2CDK4GSK3B
SCHEMBL8235871 0.84 CDK4 (0.58) PIK3C3MKNK2CDK4GSK3BCDK2
SCHEMBL8233031 0.83 PIK3C3 (0.54) PIK3C3MKNK2CDK4GSK3BCDK2
SCHEMBL8227901 0.82 CDK4 (0.57) MKNK1CDK4GSK3BCDK2RET
SCHEMBL5314566 0.82 CDK4 (0.46) MKNK1MKNK2CDK4GSK3BCDK2
SCHEMBL8235108 0.80 CDK4 (0.51) PIK3C3CDK4GSK3BCDK2RET
SCHEMBL8229248 0.80 CDK4 (0.50) PIK3C3CDK4GSK3BCDK2MAPK8
SCHEMBL8234846 0.79 CDK4 (0.44) PIK3C3CDK4GSK3BCDK2RET
SCHEMBL8233013 0.79 CDK4 (0.44) CDK4GSK3BCDK2RETMAPK1
SCHEMBL8233813 0.79 IRAK1 (0.43) MKNK1PIK3C3MKNK2CDK4GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007129195-A2 4-PYRIMIDINE-5-AMINO-PYRAZOLE COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-11-15 WO disclosed