SCHEMBL993049

SCHEMBL993049

Clc1cc(-c2c[nH]c3ncccc23)cc(NC2CCC(NC3CC[N]CC3)CC2)n1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 19/20 0.76
GSK3B P49841 11/20 0.76
PRKACA P17612 10/20 0.61
HIPK2 Q9H2X6 10/20 0.61
ROCK2 O75116 9/20 0.61
PIM1 P11309 9/20 0.61
CDK2 P24941 9/20 0.61
DAPK3 O43293 7/20 0.61
PAK4 O96013 7/20 0.61
PRKX P51817 7/20 0.61
DYRK1A Q13627 7/20 0.61
MELK Q14680 7/20 0.61
CLK4 Q9HAZ1 7/20 0.61
CDK9 P50750 7/20 0.61
MAP4K2 Q12851 6/20 0.61
STK3 Q13188 6/20 0.61
MINK1 Q8N4C8 6/20 0.61
MAP4K5 Q9Y4K4 6/20 0.61
PRKD3 O94806 6/20 0.61
FLT3 P36888 6/20 0.61

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
SCHEMBL1041772 0.92 CDC7 (0.76) CDC7GSK3BPRKACAHIPK2ROCK2
SCHEMBL1045782 0.92 CDC7 (0.90) CDC7GSK3BPRKACAHIPK2ROCK2
SCHEMBL1043445 0.92 CDC7 (0.86) CDC7GSK3BPRKACAHIPK2ROCK2
SCHEMBL1045779 0.92 CDC7 (0.90) CDC7GSK3BPRKACAHIPK2ROCK2
SCHEMBL1043448 0.92 CDC7 (0.86) CDC7GSK3BPRKACAHIPK2ROCK2
SCHEMBL1042366 0.90 CDC7 (0.76) CDC7GSK3BPRKACAHIPK2ROCK2
SCHEMBL1046255 0.90 CDC7 (0.76) CDC7GSK3BPRKACAHIPK2ROCK2
SCHEMBL1046258 0.90 CDC7 (0.76) CDC7GSK3BPRKACAHIPK2ROCK2
SCHEMBL1042369 0.90 CDC7 (0.76) CDC7GSK3BPRKACAHIPK2ROCK2
SCHEMBL1046155 0.89 CDC7 (0.74) CDC7GSK3BPRKACAHIPK2ROCK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2454257-A1 PYRROLOPYRIDINE INHIBITORS OF KINASES Abbott Laboratories (US) 2012-05-23 EP claimed
WO-2011008915-A1 PYRROLOPYRIDINE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2011-01-20 WO claimed
EP-2454257-A1 PYRROLOPYRIDINE INHIBITORS OF KINASES Abbott Laboratories (US) 2012-05-23 EP disclosed
WO-2011008915-A1 PYRROLOPYRIDINE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2011-01-20 WO disclosed