SCHEMBL27909795

SCHEMBL27909795

NC(=O)c1cc(-c2cc(F)c(F)cc2F)[nH]c1N(N)C=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 4/20 0.35
BRD4 O60885 2/20 0.33
PLK4 O00444 1/20 0.31
MAPK13 O15264 1/20 0.31
DAPK3 O43293 1/20 0.31
DYRK3 O43781 1/20 0.31
JAK2 O60674 1/20 0.31
PRKD3 O94806 1/20 0.31
CHEK2 O96017 1/20 0.31
PRKCG P05129 1/20 0.31
CDK1 P06493 1/20 0.31
PRKACA P17612 1/20 0.31
CDK2 P24941 1/20 0.31
MARK3 P27448 1/20 0.31
MAPK1 P28482 1/20 0.31
FRK P42685 1/20 0.31
MAPK8 P45983 1/20 0.31
MAPK9 P45984 1/20 0.31
CSNK1A1 P48729 1/20 0.31
CSNK1D P48730 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
SCHEMBL28804479 0.86 BRD4 (0.38) CDC7BRD4PLK4MAPK13DAPK3
SCHEMBL27767422 0.84 CDC7 (0.47) CDC7BRD4
SCHEMBL27767419 0.80 IDO1 (0.39) CDC7BRD4MAPK1
SCHEMBL27789086 0.78 BRD4 (0.44) CDC7BRD4CDK1CSNK1A1GSK3A
SCHEMBL27767416 0.78 CDC7 (0.52) CDC7BRD4JAK2CDK2
SCHEMBL27767424 0.76 IKBKB (0.43) CDC7BRD4JAK2CHEK2
SCHEMBL27789042 0.76 CASP1 (0.45) CDC7BRD4PLK4MAPK13DAPK3
SCHEMBL27767415 0.75 CDC7 (0.52) CDC7BRD4CDK2
SCHEMBL27909732 0.75 JAK2 (0.44) CDC7BRD4PLK4MAPK13DAPK3
SCHEMBL4348090 0.75 BRD4 (0.41) CDC7BRD4PLK4MAPK13DAPK3

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
CN-101622229-B Pyrrole derivatives having ureido and aminocarbonyl groups as substituents SANTEN PHARMACEUTICAL CO LTD 2013-02-27 CN claimed
CN-101622229-B Pyrrole derivatives having ureido and aminocarbonyl groups as substituents SANTEN PHARMACEUTICAL CO LTD 2013-02-27 CN disclosed