SCHEMBL4374583

SCHEMBL4374583

NC(=O)c1cccc2ccc(-c3c[nH]c4ncccc34)cc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAMKK2 Q96RR4 3/20 0.62
CDC7 O00311 7/20 0.55
CLK4 Q9HAZ1 5/20 0.52
ROCK2 O75116 4/20 0.52
PIM1 P11309 3/20 0.52
CDK2 P24941 3/20 0.52
GSK3B P49841 3/20 0.52
MAP4K4 O95819 3/20 0.52
PRKACA P17612 2/20 0.52
HIPK2 Q9H2X6 2/20 0.52
IRAK4 Q9NWZ3 1/20 0.52
JAK3 P52333 3/20 0.51
CAMKK1 Q8N5S9 1/20 0.51
DYRK1B Q9Y463 3/20 0.50
NEK2 P51955 2/20 0.49
PLK1 P53350 1/20 0.49
DYRK1A Q13627 9/20 0.48
STK17A Q9UEE5 4/20 0.48
ROCK1 Q13464 3/20 0.48
MELK Q14680 3/20 0.48

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
SCHEMBL8939866 0.80 CAMKK2 (0.76) CAMKK2CDC7CLK4ROCK2PIM1
SCHEMBL1666076 0.78 BRD4 (0.63) CAMKK2CDC7CAMKK1DYRK1AFLT3
SCHEMBL1665897 0.78 CAMKK2 (0.61) CAMKK2CDC7CAMKK1DYRK1AFLT3
SCHEMBL8939859 0.77 CAMKK2 (1.00) CAMKK2CDC7CLK4ROCK2PIM1
SCHEMBL7053843 0.77 CAMKK2 (0.63) CAMKK2CDC7CLK4ROCK2PIM1
SCHEMBL30563455 0.77 NUDT1 (0.67) CAMKK2CDC7PIM1CDK2DYRK1B
SCHEMBL15397131 0.77 DYRK1A (0.61) CAMKK2CDC7CLK4ROCK2PIM1
SCHEMBL29775980 0.75 CDC7 (0.59) CAMKK2CDC7CLK4ROCK2PIM1
SCHEMBL26931341 0.75 CDC7 (0.59) CAMKK2CDC7CLK4ROCK2PIM1
SCHEMBL3330981 0.74 CDC7 (0.72) CAMKK2CDC7CLK4ROCK2PIM1

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-2038272-A2 PYRIDINONYL PDK1 INHIBITORS Sunesis Pharmaceuticals, Inc. (US) 2009-03-25 EP disclosed
WO-2008005457-A2 PYRIDINONYL PDK1 INHIBITORS SUNESIS PHARMACEUTICALS (US) 2008-01-10 WO disclosed