SCHEMBL5757963

SCHEMBL5757963

CN(C)CCCn1nc(C2=C(c3cn(-c4cccs4)c4ccc(Cl)cc34)C(=O)NC2=O)c2ccccc21

nearest known ligand 0.85

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 15/20 0.85
PRKCB P05771 14/20 0.85
GSK3B P49841 13/20 0.85
PRKCG P05129 12/20 0.85
PRKCD Q05655 7/20 0.85
KCNH2 Q12809 7/20 0.62
PRKCZ Q05513 3/20 0.62
KISS1R Q969F8 1/20 0.50
PRKCE Q02156 2/20 0.44
PRKCH P24723 1/20 0.44
PRKCQ Q04759 1/20 0.44
PRKACA P17612 2/20 0.44
PRKACG P22612 2/20 0.44
PRKACB P22694 2/20 0.44
PIM1 P11309 1/20 0.43
CAMK2D Q13557 1/20 0.42

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
SCHEMBL3774803 0.92 PRKCA (1.00) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL3771437 0.88 PRKCA (0.84) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL5757844 0.86 GSK3B (0.67) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL5754128 0.85 PRKCA (0.85) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL3779533 0.84 PRKCA (0.64) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL5758690 0.83 PRKCA (0.63) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL3771589 0.83 PRKCA (0.84) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL5758532 0.80 PRKCA (0.84) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL3772597 0.80 PRKCA (0.77) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL3774999 0.80 GSK3B (0.77) 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