SCHEMBL4683103

SCHEMBL4683103

CN(C)CCCn1cc(C2=C(c3ccccc3OCC(O)CN(C)C)C(=O)NC2=O)c2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 10/20 0.64
PRKACA P17612 3/20 0.64
PRKACG P22612 3/20 0.64
PRKACB P22694 3/20 0.64
PIM1 P11309 2/20 0.64
PRKCB P05771 9/20 0.64
PRKCH P24723 3/20 0.64
PRKCQ Q04759 3/20 0.64
PRKCD Q05655 3/20 0.64
CCNB2 O95067 3/20 0.62
CDK1 P06493 3/20 0.62
CCNB1 P14635 3/20 0.62
CCNB3 Q8WWL7 3/20 0.62
FLT3 P36888 1/20 0.59
PRKCE Q02156 7/20 0.59
GSK3B P49841 6/20 0.59
PRKCG P05129 2/20 0.59
PRKD1 Q15139 2/20 0.59
TDP1 Q9NUW8 2/20 0.59
MEN1 O00255 1/20 0.59

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
SCHEMBL4683218 0.91 GSK3B (0.55) PRKCAPRKACAPRKACGPRKACBPIM1
SCHEMBL4684125 0.88 PRKCA (0.62) PRKCAPRKACAPRKACGPRKACBPIM1
SCHEMBL2946233 0.82 PRKCA (0.51) PRKCAPRKACAPRKACGPRKACBPIM1
SCHEMBL7057981 0.79 PRKCA (1.00) PRKCAPRKACAPRKACGPRKACBPIM1
SCHEMBL4675538 0.78 PRKCA (1.00) PRKCAPRKACAPRKACGPRKACBPIM1
Hydrochloric Acid SCHEMBL8154146 0.78 PRKCA (0.98) PRKCAPRKACAPRKACGPRKACBPIM1
SCHEMBL7522437 0.77 CCNE2 (0.67) PRKCAGSK3BCCNE2CDK4CCND1
SCHEMBL12506833 0.75 FLT3 (1.00) PRKCAPRKACAPRKACGPRKACBPIM1
Gf-109203 SCHEMBL29353725 0.75 PRKACA (1.00) PRKCAPRKACAPRKACGPRKACBPIM1
Gf-109203 SCHEMBL338086 0.75 PRKACA (1.00) PRKCAPRKACAPRKACGPRKACBPIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1513520-B1 SUBSTITUTED PYRROLINES AS KINASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2008-09-24 EP disclosed