SCHEMBL14380903

SCHEMBL14380903

NC(=O)Cc1cccc(Nc2nccc(-n3c(N)nc4ccccc43)n2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 4/20 0.52
MKNK1 Q9BUB5 2/20 0.45
MKNK2 Q9HBH9 2/20 0.45
CDK2 P24941 1/20 0.44
PIK3CA P42336 1/20 0.43
MTOR P42345 1/20 0.43
CHEK1 O14757 1/20 0.42
MAP3K7 O43318 1/20 0.42
NUAK1 O60285 1/20 0.42
JAK2 O60674 1/20 0.42
BMX P51813 1/20 0.42
NEK2 P51955 1/20 0.42
MAP3K9 P80192 1/20 0.42
MAP2K1 Q02750 1/20 0.42
MAP3K11 Q16584 1/20 0.42
TBK1 Q9UHD2 1/20 0.42
CCNT1 O60563 2/20 0.41
CDK9 P50750 2/20 0.41
CDK1 P06493 1/20 0.41
CCNB1 P14635 1/20 0.41

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
SCHEMBL14380902 0.86 MKNK1 (0.55) AURKAMKNK1MKNK2PIK3CAMTOR
SCHEMBL6479199 0.85 PIK3CA (0.52) AURKAPIK3CAMTORCHEK1MAP3K7
SCHEMBL14380901 0.80 MKNK1 (0.69) AURKAMKNK1MKNK2CDK2JAK2
SCHEMBL6485821 0.77 PIK3CA (0.52) AURKAPIK3CAMTORCHEK1MAP3K7
SCHEMBL14380908 0.73 MAPK8 (0.47) MKNK1MKNK2JAK2CCNT1CDK9
SCHEMBL6479848 0.73 PIK3CA (0.54) PIK3CAMTORKDRLCK
SCHEMBL14380858 0.72 KDR (0.56) CDK2PIK3CAJAK2KDRALK
SCHEMBL14214732 0.71 SCN9A (0.59) PIK3CAMTOR
SCHEMBL14380906 0.70 MKNK1 (0.40) MKNK1MKNK2CDK2PIK3CAMTOR
SCHEMBL14380899 0.69 MKNK1 (0.80) MKNK1MKNK2CDK2LCK

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
US-7282504-B2 Kinase inhibitors AMGEN INC. (US) 2007-10-16 US disclosed
US-7282504-B2 Kinase inhibitors AMGEN INC. (US) 2007-10-16 US disclosed