SCHEMBL13770744

SCHEMBL13770744

CCOc1ccc(-c2ccnc(NCCc3ccc(O)c(O)c3)n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 5/20 0.47
CLK4 Q9HAZ1 5/20 0.47
DYRK1B Q9Y463 3/20 0.47
CLK1 P49759 3/20 0.47
CLK2 P49760 2/20 0.47
MKNK1 Q9BUB5 2/20 0.43
MKNK2 Q9HBH9 2/20 0.43
CCNT1 O60563 2/20 0.42
CCNA2 P20248 2/20 0.42
CDK2 P24941 2/20 0.42
CDK9 P50750 2/20 0.42
PTPN1 P18031 1/20 0.41
MAPT P10636 4/20 0.41
JAK2 O60674 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
TP53 P04637 3/20 0.40
CYP1A2 P05177 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL1467417 0.90 MAPT (0.48) DYRK1ACLK4DYRK1BCLK1CLK2
SCHEMBL1467601 0.88 CLK1 (0.49) DYRK1ACLK4DYRK1BCLK1CLK2
SCHEMBL1467639 0.82 DYRK1A (0.47) DYRK1ACLK4DYRK1BCLK1CLK2
SCHEMBL22887017 0.82 MKNK1 (0.55) DYRK1ACLK4DYRK1BCLK1CLK2
SCHEMBL1467431 0.75 CCNT1 (0.48) DYRK1ACLK4DYRK1BCLK1CLK2
SCHEMBL1469459 0.73 DYRK1A (0.50) DYRK1ACLK4DYRK1BCLK1MKNK1
SCHEMBL27793973 0.72 IGF1R (0.60) MAPTALOX15KDM4EALDH1A1
SCHEMBL1466687 0.71 DYRK1A (0.50) DYRK1ACLK4DYRK1BCLK1MKNK1
SCHEMBL4736883 0.70 PIK3CG (0.62) CDK2MAPTJAK2
SCHEMBL1468014 0.70 DYRK1A (0.51) DYRK1ACLK4DYRK1BCLK1MKNK1

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
EP-1701944-B1 2-(AMINO-SUBSTITUTED)-4-ARYL PYRAMIDINES AND RELATED COMPOUNDS USEFUL FOR TREATING INFLAMMATORY DISEASES MILLENNIUM PHARM INC (US) 2009-07-29 EP disclosed