SCHEMBL5755667

SCHEMBL5755667

CN(C)CCCn1nc(C2=C(c3cn(-c4cccc(Br)c4)c4ccccc34)C(=O)NC2=O)c2ccccc21

nearest known ligand 0.82

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 14/20 0.82
GSK3B P49841 13/20 0.82
PRKCB P05771 13/20 0.82
PRKCG P05129 12/20 0.82
PRKCD Q05655 7/20 0.78
KCNH2 Q12809 7/20 0.78
PRKCZ Q05513 3/20 0.78
KISS1R Q969F8 1/20 0.52
PRKACA P17612 2/20 0.49
PRKACG P22612 2/20 0.49
PRKACB P22694 2/20 0.49
PRKCH P24723 1/20 0.49
PRKCQ Q04759 1/20 0.49
PIM1 P11309 1/20 0.49
CAMK2D Q13557 1/20 0.46

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
SCHEMBL5814373 0.90 PRKCA (1.00) PRKCAGSK3BPRKCBPRKCGPRKCD
SCHEMBL3779553 0.90 PRKCA (0.85) PRKCAGSK3BPRKCBPRKCGPRKCD
SCHEMBL3774124 0.87 PRKCA (1.00) PRKCAGSK3BPRKCBPRKCGPRKCD
SCHEMBL13013272 0.86 GSK3B (1.00) PRKCAGSK3BPRKCBPRKCGPRKCD
SCHEMBL5756774 0.86 GSK3B (0.88) PRKCAGSK3BPRKCBPRKCGPRKCD
SCHEMBL3774763 0.85 PRKCA (0.85) PRKCAGSK3BPRKCBPRKCGPRKCD
SCHEMBL5758398 0.85 PRKCA (0.74) PRKCAGSK3BPRKCBPRKCGPRKCD
SCHEMBL5759641 0.85 PRKCA (0.95) PRKCAGSK3BPRKCBPRKCGPRKCD
SCHEMBL5758194 0.85 GSK3B (0.88) PRKCAGSK3BPRKCBPRKCGPRKCD
SCHEMBL5758882 0.84 GSK3B (0.73) PRKCAGSK3BPRKCBPRKCGPRKCD

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