SCHEMBL1934458

SCHEMBL1934458

O=Cc1cnn2c(OC(=O)NCC3CC3)cc(Cl)nc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2B P67870 1/20 0.39
ACACB O00763 1/20 0.35
ACACA Q13085 1/20 0.35
PDE4D Q08499 2/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
BACE1 P56817 1/20 0.32
ALDH1A1 P00352 2/20 0.32
RAB9A P51151 2/20 0.31
MITF O75030 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
RECQL P46063 1/20 0.31
MDM2 Q00987 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CACNA1I Q9P0X4 2/20 0.31
KCNH2 Q12809 1/20 0.31
P2RX7 Q99572 1/20 0.31

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
SCHEMBL17182917 0.81 PDE4D (0.40) PDE4DRAB9ATTKNPC1
SCHEMBL1486090 0.78 CSNK2B (0.48) CSNK2BPDE4DTTK
SCHEMBL1934456 0.74 CSNK2B (0.43) CSNK2B
SCHEMBL12583210 0.73 CSNK2B (0.43) CSNK2B
SCHEMBL14158106 0.73 CSNK2B (0.39) CSNK2B
SCHEMBL12583401 0.70 CSNK2B (0.35) CSNK2BACACBACACA
SCHEMBL1486064 0.69 CSNK2B (0.69) CSNK2BRAB9ANPC1
SCHEMBL1933440 0.69 CSNK2B (0.41) CSNK2B
SCHEMBL21493273 0.68 TTK (0.45) TTK
SCHEMBL1486089 0.67 CSNK2B (0.44) CSNK2B

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-2011068667-A1 PYRAZOLOPYRIMIDINES AND RELATED HETEROCYCLES AS CK2 INHIBITORS CYLENE PHARMACEUTICALS, INC. (US) 2011-06-09 WO disclosed