SCHEMBL14216034

SCHEMBL14216034

Cc1cc(C)cc(Nc2nccc(-c3nc(C)c(CN)s3)n2)c1

nearest known ligand 0.76

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SYK P43405 15/20 0.76
ZAP70 P43403 13/20 0.76
SRC P12931 11/20 0.76
CDK2 P24941 9/20 0.65
CDK4 P11802 4/20 0.46
AURKA O14965 2/20 0.46
CDK1 P06493 2/20 0.46
CDK7 P50613 2/20 0.46
CDK9 P50750 2/20 0.46
JAK2 O60674 2/20 0.45
FLT3 P36888 2/20 0.45
GSK3B P49841 1/20 0.45
AURKB Q96GD4 1/20 0.44
KDR P35968 1/20 0.43

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
SCHEMBL14216049 0.88 SYK (0.76) SYKZAP70SRCCDK2CDK4
SCHEMBL14216043 0.88 SYK (0.83) SYKZAP70SRCCDK2CDK4
SCHEMBL14216038 0.87 SYK (0.67) SYKZAP70SRCCDK2CDK4
SCHEMBL14216026 0.86 SYK (0.72) SYKZAP70SRCCDK2CDK4
SCHEMBL5036950 0.86 SYK (1.00) SYKZAP70SRCCDK2CDK4
SCHEMBL14216055 0.86 SYK (0.72) SYKZAP70SRCCDK2CDK4
SCHEMBL14216036 0.84 SYK (0.70) SYKZAP70SRCCDK2CDK4
SCHEMBL14216033 0.84 SYK (0.70) SYKZAP70SRCCDK2CDK4
SCHEMBL14216305 0.84 SYK (0.77) SYKZAP70SRCCDK2CDK4
SCHEMBL14216133 0.84 SYK (0.77) SYKZAP70SRCCDK2CDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1605946-B1 THIAZOLES USEFUL AS INHIBITORS OF PROTEIN KINASES VERTEX PHARMA (US) 2008-05-28 EP disclosed
US-7276502-B2 Thiazoles useful as inhibitors of protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-10-02 US disclosed
US-7276502-B2 Thiazoles useful as inhibitors of protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-10-02 US disclosed