SCHEMBL14216022

SCHEMBL14216022

Cc1cc(C)cc(Nc2nccc(-c3nc(CN)cs3)n2)c1

nearest known ligand 0.79

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 17/20 0.79
ZAP70 P43403 15/20 0.79
SRC P12931 13/20 0.79
CDK2 P24941 7/20 0.79
JAK2 O60674 2/20 0.45
FLT3 P36888 2/20 0.45
CDK4 P11802 1/20 0.45
GSK3B P49841 1/20 0.45
KDR P35968 1/20 0.43
BRD4 O60885 1/20 0.42
BRD2 P25440 1/20 0.42
BRD3 Q15059 1/20 0.42
BRDT Q58F21 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
SCHEMBL5038586 0.88 SYK (1.00) SYKZAP70SRCCDK2JAK2
SCHEMBL5037349 0.88 SYK (0.79) SYKZAP70SRCCDK2JAK2
SCHEMBL14216163 0.86 SYK (0.76) SYKZAP70SRCCDK2JAK2
SCHEMBL5036868 0.86 SYK (0.76) SYKZAP70SRCCDK2JAK2
SCHEMBL5038582 0.85 SYK (0.74) SYKZAP70SRCCDK2JAK2
SCHEMBL5034190 0.84 SYK (0.76) SYKZAP70SRCCDK2JAK2
SCHEMBL14216294 0.84 SYK (0.77) SYKZAP70SRCCDK2CDK4
SCHEMBL14216009 0.83 SYK (0.70) SYKZAP70SRCCDK2JAK2
SCHEMBL14378908 0.82 SYK (0.70) SYKZAP70SRCCDK2JAK2
SCHEMBL5140826 0.82 SYK (0.69) 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