SCHEMBL4680242

SCHEMBL4680242

CN(C)CCn1cc(C2=C(c3csc4ccc(Cl)cc34)C(=O)NC2=O)c2ccccc21

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 8/20 0.72
PRKCB P05771 7/20 0.72
PRKCE Q02156 5/20 0.72
PRKCH P24723 3/20 0.72
PRKCQ Q04759 3/20 0.72
PRKCD Q05655 3/20 0.72
CAMK2D Q13557 1/20 0.59
GSK3B P49841 5/20 0.57
KDR P35968 1/20 0.57
PRKACA P17612 3/20 0.56
PRKACG P22612 3/20 0.56
PRKACB P22694 3/20 0.56
PIM1 P11309 2/20 0.56
CCNB2 O95067 4/20 0.52
CDK1 P06493 4/20 0.52
CCNB1 P14635 4/20 0.52
CCNB3 Q8WWL7 4/20 0.52
MEN1 O00255 2/20 0.52
TP53 P04637 2/20 0.52
CYP1A2 P05177 2/20 0.52

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
SCHEMBL4740368 0.95 PRKCA (0.67) PRKCAPRKCBPRKCEPRKCHPRKCQ
SCHEMBL2945607 0.95 PRKCA (0.81) PRKCAPRKCBPRKCEPRKCHPRKCQ
SCHEMBL4680012 0.91 PRKCA (0.61) PRKCAPRKCBPRKCEPRKCHPRKCQ
SCHEMBL2955891 0.89 PRKCA (0.59) PRKCAPRKCBPRKCEPRKCHPRKCQ
SCHEMBL2954303 0.88 PRKCA (0.59) PRKCAPRKCBPRKCEPRKCHPRKCQ
SCHEMBL2950533 0.88 PRKCA (0.59) PRKCAPRKCBPRKCEPRKCHPRKCQ
SCHEMBL6192685 0.87 CAMK2D (0.57) PRKCAPRKCBPRKCEPRKCHPRKCQ
SCHEMBL4675316 0.86 PRKCA (0.56) PRKCAPRKCBPRKCEPRKCHPRKCQ
SCHEMBL4676201 0.86 CAMK2D (0.65) PRKCAPRKCBPRKCEPRKCHPRKCQ
SCHEMBL4676611 0.86 PRKCA (0.65) PRKCAPRKCBPRKCEPRKCHPRKCQ

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