SCHEMBL7842250

SCHEMBL7842250

CN(C)CCn1cc(C2=C(Nc3ccccc3)C(=O)NC2=O)c2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 16/20 1.00
PRKCB P05771 15/20 1.00
PRKCE Q02156 11/20 0.88
GSK3B P49841 3/20 0.68
JAK2 O60674 1/20 0.62
JAK1 P23458 1/20 0.62
TYK2 P29597 1/20 0.62
JAK3 P52333 1/20 0.62
PRKACA P17612 3/20 0.62
PRKACG P22612 3/20 0.62
PRKACB P22694 3/20 0.62
PIM1 P11309 2/20 0.62
KDR P35968 1/20 0.59
PRKCH P24723 3/20 0.59
PRKCQ Q04759 3/20 0.59
PRKCD Q05655 3/20 0.59
CCNB2 O95067 2/20 0.57
CDK1 P06493 2/20 0.57
CCNB1 P14635 2/20 0.57
CCNB3 Q8WWL7 2/20 0.57

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
SCHEMBL7838765 0.94 PRKCA (0.88) PRKCAPRKCBPRKCEGSK3BJAK2
SCHEMBL7830800 0.94 PRKCA (1.00) PRKCAPRKCBPRKCEGSK3BJAK2
SCHEMBL7843214 0.93 PRKCA (1.00) PRKCAPRKCBPRKCEGSK3BJAK2
SCHEMBL7842630 0.90 PRKCA (0.89) PRKCAPRKCBPRKCEGSK3BJAK2
SCHEMBL7843888 0.85 PRKCA (0.81) PRKCAPRKCBPRKCEGSK3BJAK2
SCHEMBL7840914 0.85 PRKCB (0.87) PRKCAPRKCBPRKCEGSK3BJAK2
SCHEMBL7831816 0.84 PRKCA (1.00) PRKCAPRKCBPRKCEGSK3BJAK2
SCHEMBL7842285 0.83 PRKCB (1.00) PRKCAPRKCBPRKCEGSK3BJAK2
SCHEMBL7830883 0.83 PRKCB (0.80) PRKCAPRKCBPRKCEGSK3BJAK2
SCHEMBL7841721 0.83 PRKCA (1.00) PRKCAPRKCBPRKCEGSK3BJAK2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1120414-A1 DISUBSTITUTED MALEIMIDE COMPOUNDS AND MEDICINAL UTILIZATION THEREOF JAPAN TOBACCO INC. (JP) 2001-08-01 EP claimed
EP-1120414-A1 DISUBSTITUTED MALEIMIDE COMPOUNDS AND MEDICINAL UTILIZATION THEREOF JAPAN TOBACCO INC. (JP) 2001-08-01 EP disclosed