SCHEMBL4758874

SCHEMBL4758874

Cc1cc(-c2cc(-c3cccc(C(=O)NCCNc4ccccc4)c3)[nH]c(=O)n2)ccc1O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 4/20 0.63
PIM1 P11309 3/20 0.63
GSK3B P49841 2/20 0.63
CSNK2A1 P68400 2/20 0.63
CSNK2A2 P19784 1/20 0.63
CLK1 P49759 1/20 0.63
CSNK2B P67870 1/20 0.63
CSNK2A3 Q8NEV1 1/20 0.63
ALDH1A1 P00352 3/20 0.42
MAPK1 P28482 3/20 0.42
MAPT P10636 1/20 0.42
KDM4E B2RXH2 4/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
MMP8 P22894 1/20 0.41
NPY1R P25929 1/20 0.41
RECQL P46063 1/20 0.41
NPY2R P49146 1/20 0.41

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
SCHEMBL383428 0.87 PIM1 (0.60) CDC7PIM1GSK3BCSNK2A1CSNK2A2
SCHEMBL383364 0.87 PIM1 (0.62) CDC7PIM1GSK3BCSNK2A1CSNK2A2
SCHEMBL3328360 0.86 PIM1 (0.61) CDC7PIM1GSK3BCSNK2A1CSNK2A2
SCHEMBL385759 0.86 PIM1 (0.61) CDC7PIM1GSK3BCSNK2A1CSNK2A2
SCHEMBL3330958 0.86 CDC7 (0.61) CDC7PIM1GSK3BCSNK2A1CSNK2A2
SCHEMBL3331227 0.86 PIM1 (0.58) CDC7PIM1GSK3BCSNK2A1CSNK2A2
SCHEMBL385521 0.85 PIM1 (0.60) CDC7PIM1GSK3BCSNK2A1CSNK2A2
SCHEMBL3329151 0.85 CDC7 (0.59) CDC7PIM1GSK3BCSNK2A1CSNK2A2
SCHEMBL383423 0.85 PIM1 (0.59) CDC7PIM1GSK3BCSNK2A1CSNK2A2
SCHEMBL12514652 0.84 PIM1 (0.58) CDC7PIM1GSK3BCSNK2A1CSNK2A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1948617-A2 PYRIMIDINONES AS CASEIN KINASE II (CK2) MODULATORS Exelixis, Inc. (US) 2008-07-30 EP claimed
WO-2007048065-A2 PYRIMIDINONES AS CASEIN KINASE II (CK2) MODULATORS EXELIXIS, INC. (US) 2007-04-26 WO claimed