SCHEMBL5758532

SCHEMBL5758532

C=Cn1cc(C2=C(c3nn(CCCN(C)C)c4ccc(Cl)cc34)C(=O)NC2=O)c2ccccc21

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 15/20 0.84
PRKCB P05771 14/20 0.84
GSK3B P49841 13/20 0.84
PRKCG P05129 11/20 0.84
PRKCD Q05655 9/20 0.60
KCNH2 Q12809 6/20 0.60
PRKCZ Q05513 4/20 0.60
PRKCE Q02156 3/20 0.48
PRKACA P17612 3/20 0.48
PRKACG P22612 3/20 0.48
PRKACB P22694 3/20 0.48
PIM1 P11309 2/20 0.48
PRKCH P24723 3/20 0.46
PRKCQ Q04759 3/20 0.46
MEN1 O00255 1/20 0.45
PRKD3 O94806 1/20 0.45
CCNB2 O95067 1/20 0.45
CCNE2 O96020 1/20 0.45
TP53 P04637 1/20 0.45
CYP1A2 P05177 1/20 0.45

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
SCHEMBL3771589 0.97 PRKCA (0.84) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL5758306 0.92 GSK3B (1.00) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL5757844 0.86 GSK3B (0.67) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL13013303 0.85 PRKCA (0.63) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL3775971 0.85 GSK3B (0.61) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL3771437 0.85 PRKCA (0.84) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL3783864 0.85 PRKCA (0.80) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL3779533 0.84 PRKCA (0.64) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL5758690 0.83 PRKCA (0.63) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL3770811 0.82 PRKCA (0.66) PRKCAPRKCBGSK3BPRKCGPRKCD

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-1362047-B1 INDAZOLYL-SUBSTITUTED PYRROLINE COMPOUNDS AS KINASE INHIBITORS ORTHO MCNEIL PHARM INC (US) 2006-05-17 EP disclosed