SCHEMBL14216044

SCHEMBL14216044

CC(=O)OCc1sc(-c2ccnc(Nc3cc(C)cc(C)c3)n2)nc1C

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SYK P43405 20/20 0.69
ZAP70 P43403 12/20 0.69
SRC P12931 10/20 0.69
CDK2 P24941 5/20 0.56
JAK2 O60674 6/20 0.45
FLT3 P36888 6/20 0.45
LYN P07948 1/20 0.42

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
SCHEMBL14216055 0.86 SYK (0.72) SYKZAP70SRCCDK2JAK2
SCHEMBL14216043 0.86 SYK (0.83) SYKZAP70SRCCDK2JAK2
SCHEMBL14379045 0.86 SYK (0.56) SYKZAP70SRCCDK2JAK2
SCHEMBL14216036 0.84 SYK (0.70) SYKZAP70SRCCDK2JAK2
SCHEMBL14216037 0.84 SYK (0.76) SYKZAP70SRCCDK2JAK2
SCHEMBL14216221 0.84 SYK (0.72) SYKZAP70SRCCDK2JAK2
SCHEMBL5036950 0.82 SYK (1.00) SYKZAP70SRCCDK2JAK2
SCHEMBL14216049 0.82 SYK (0.76) SYKZAP70SRCCDK2JAK2
SCHEMBL14216034 0.82 SYK (0.76) SYKZAP70SRCCDK2JAK2
SCHEMBL14216051 0.80 ZAP70 (0.67) SYKZAP70SRCCDK2

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