SCHEMBL14216045

SCHEMBL14216045

Cc1cc(C)cc(Nc2nccc(-c3nc(C)c(CN(C)C4CCCCC4)s3)n2)c1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SYK P43405 16/20 0.62
ZAP70 P43403 12/20 0.62
SRC P12931 10/20 0.62
CDK2 P24941 5/20 0.53
ABL1 P00519 1/20 0.42
BRD4 O60885 1/20 0.42
BRD2 P25440 1/20 0.42
BRD3 Q15059 1/20 0.42
BRDT Q58F21 1/20 0.42
JAK2 O60674 2/20 0.41
FLT3 P36888 2/20 0.41
JAK3 P52333 2/20 0.40
LYN P07948 1/20 0.40
LCK P06239 1/20 0.39

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
SCHEMBL14216026 0.85 SYK (0.72) SYKZAP70SRCCDK2JAK2
SCHEMBL14216033 0.81 SYK (0.70) SYKZAP70SRCCDK2JAK2
SCHEMBL14216322 0.80 SYK (0.74) SYKZAP70SRCCDK2JAK2
SCHEMBL14216133 0.79 SYK (0.77) SYKZAP70SRCCDK2JAK2
SCHEMBL14216053 0.79 SYK (0.66) SYKZAP70SRCCDK2JAK2
SCHEMBL14216043 0.78 SYK (0.83) SYKZAP70SRCCDK2JAK2
SCHEMBL14216034 0.78 SYK (0.76) SYKZAP70SRCCDK2JAK2
SCHEMBL14216049 0.78 SYK (0.76) SYKZAP70SRCCDK2BRD4
SCHEMBL14216309 0.77 SYK (0.67) SYKZAP70SRCCDK2JAK2
SCHEMBL14216055 0.77 SYK (0.72) SYKZAP70SRCCDK2JAK2

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