SCHEMBL4676818

SCHEMBL4676818

C=Cn1cc(C2=C(c3c(O)ccc4ccccc34)C(=O)NC2=O)c2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PRKCB P05771 7/20 0.48
PRKCA P17252 6/20 0.48
GSK3B P49841 4/20 0.48
PRKCG P05129 2/20 0.48
CCNE2 O96020 1/20 0.45
CDK4 P11802 1/20 0.45
CCND1 P24385 1/20 0.45
CCNE1 P24864 1/20 0.45
CDK2 P24941 1/20 0.45
CAMK2D Q13557 1/20 0.42
PRKCD Q05655 3/20 0.41
PRKCE Q02156 2/20 0.40
PRKCH P24723 1/20 0.40
PRKCQ Q04759 1/20 0.40

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
SCHEMBL4680124 0.76 PRKCA (0.47) PRKCBPRKCAGSK3BPRKCGCCNE2
SCHEMBL2954257 0.67 GSK3B (0.43) PRKCBPRKCAGSK3BPRKCGCCNE2
SCHEMBL2946233 0.66 PRKCA (0.51) PRKCBPRKCAGSK3BPRKCGCCNE2
SCHEMBL5754952 0.66 PRKCA (0.67) PRKCBPRKCAGSK3BPRKCGCCNE2
SCHEMBL8161830 0.65 CCNE2 (0.81) PRKCBPRKCAGSK3BCCNE2CDK4
SCHEMBL7825912 0.64 CDK2 (0.66) PRKCBPRKCAGSK3BPRKCGCCNE2
SCHEMBL5686048 0.64 CCNE2 (1.00) PRKCAGSK3BCCNE2CDK4CCND1
SCHEMBL30319849 0.64 CCNE2 (1.00) PRKCAGSK3BCCNE2CDK4CCND1
SCHEMBL24622133 0.62 CDK4 (0.74) PRKCAGSK3BCCNE2CDK4CCND1
Acrylic Acid SCHEMBL5099069 0.62 WDR5 (0.50)

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