SCHEMBL5819630

SCHEMBL5819630

Cc1cccc(-c2nc3ccccn3c2-c2ccnc(NCC(C)(C)N)n2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 10/20 0.49
CDK4 P11802 5/20 0.49
CCNE1 P24864 4/20 0.49
HDAC1 Q13547 4/20 0.44
PRKD3 O94806 2/20 0.43
MAPK9 P45984 2/20 0.43
CSNK1A1 P48729 2/20 0.43
CSNK1D P48730 2/20 0.43
PRKD2 Q9BZL6 2/20 0.43
CLK4 Q9HAZ1 2/20 0.43
MAP4K4 O95819 1/20 0.43
MATK P42679 1/20 0.43
MAPK8 P45983 1/20 0.43
LIMK1 P53667 1/20 0.43
CSNK1G2 P78368 1/20 0.43
TAOK1 Q7L7X3 1/20 0.43
MINK1 Q8N4C8 1/20 0.43
CSNK1G1 Q9HCP0 1/20 0.43
MAP3K20 Q9NYL2 1/20 0.43
MAP4K5 Q9Y4K4 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
SCHEMBL5819642 0.85 CDK2 (0.49) CDK2CDK4CCNE1HDAC1CDK19
SCHEMBL415283 0.85 CDK2 (0.49) CDK2CDK4CCNE1HDAC1PRKD3
SCHEMBL414098 0.84 CDK2 (0.48) CDK2CDK4CCNE1HDAC1PRKD3
SCHEMBL409738 0.84 HDAC1 (0.56) CDK2CDK4CCNE1HDAC1
SCHEMBL412401 0.84 CDK2 (0.56) CDK2CDK4CCNE1HDAC1CDK19
SCHEMBL413670 0.83 CDK19 (0.49) CDK2CDK4CCNE1HDAC1CDK19
SCHEMBL412332 0.83 DYRK3 (0.54) CDK2CDK4CCNE1HDAC1PRKD3
SCHEMBL414114 0.83 MAPK1 (0.53) CDK2CDK4CCNE1HDAC1PRKD3
SCHEMBL3360699 0.83 HDAC1 (0.54) CDK2CDK4CCNE1HDAC1CDK19
SCHEMBL5138510 0.81 CDK2 (0.53) CDK2CDK4CCNE1HDAC1PRKD3

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
EP-1546112-A4 IMIDAZOLOPYRIDINES AND METHODS OF MAKING AND USING THE SAME BIOGEN IDEC INC (US) 2006-06-07 EP disclosed
EP-1546112-A2 IMIDAZOLOPYRIDINES AND METHODS OF MAKING AND USING THE SAME Biogen Idec MA Inc. (US) 2005-06-29 EP disclosed
WO-2004021989-A2 IMIDAZOLOPYRIDINES AND METHODS OF MAKING AND USING THE SAME BIOGEN IDEC MA INC. (US) 2004-03-18 WO disclosed