SCHEMBL1926072

SCHEMBL1926072

Cc1nc2ccc(Nc3nccc(Nc4c(NC(C)(C)C)c(=O)c4=O)n3)cc2s1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 19/20 0.74
PLK4 O00444 3/20 0.60
CHEK1 O14757 3/20 0.60
PDPK1 O15530 3/20 0.60
ROCK2 O75116 3/20 0.60
CHEK2 O96017 3/20 0.60
CSF1R P07333 3/20 0.60
PIM1 P11309 3/20 0.60
FLT1 P17948 3/20 0.60
FGFR3 P22607 3/20 0.60
MARK3 P27448 3/20 0.60
MAPK1 P28482 3/20 0.60
KDR P35968 3/20 0.60
FLT3 P36888 3/20 0.60
MAPK9 P45984 3/20 0.60
GSK3A P49840 3/20 0.60
LIMK1 P53667 3/20 0.60
CDK5 Q00535 3/20 0.60
ROCK1 Q13464 3/20 0.60
MARK2 Q7KZI7 3/20 0.60

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
SCHEMBL1926077 0.92 PLK1 (0.68) PLK1PLK4CHEK1PDPK1ROCK2
SCHEMBL1925876 0.85 PLK1 (1.00) PLK1PLK4CHEK1PDPK1ROCK2
SCHEMBL4676011 0.84 PLK1 (0.55) PLK1PLK4CHEK1PDPK1ROCK2
SCHEMBL1926625 0.81 PLK1 (0.85) PLK1PLK4CHEK1PDPK1ROCK2
SCHEMBL1926838 0.81 PLK1 (0.68) PLK1PLK4CHEK1PDPK1ROCK2
SCHEMBL1925831 0.80 PLK1 (0.68) PLK1PLK4CHEK1PDPK1ROCK2
SCHEMBL1927390 0.80 PLK1 (0.70) PLK1PLK4CHEK1PDPK1ROCK2
SCHEMBL1926979 0.79 PLK1 (0.65) PLK1PLK4CHEK1PDPK1ROCK2
SCHEMBL1927181 0.79 PLK1 (0.65) PLK1PLK4CHEK1PDPK1ROCK2
SCHEMBL1926618 0.79 PLK1 (0.74) PLK1PLK4CHEK1PDPK1ROCK2

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
US-7956185-B2 Cyclobut-3-ene-1,2,-dione inhibitors of polo-like kinases ABBOTT LABORATORIES (US) 2011-06-07 US claimed
US-7956185-B2 Cyclobut-3-ene-1,2,-dione inhibitors of polo-like kinases ABBOTT LABORATORIES (US) 2011-06-07 US disclosed