SCHEMBL14216039

SCHEMBL14216039

CNC(=O)c1sc(-c2ccnc(Nc3cc(C)cc(C)c3)n2)nc1C

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 17/20 0.74
ZAP70 P43403 12/20 0.74
SRC P12931 10/20 0.63
CDK2 P24941 5/20 0.62
KDM4E B2RXH2 1/20 0.55
GAA P10253 1/20 0.55
JAK2 O60674 4/20 0.48
FLT3 P36888 3/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL14216141 0.90 SYK (0.70) SYKZAP70SRCCDK2KDM4E
SCHEMBL14216139 0.88 SYK (0.67) SYKZAP70SRCCDK2JAK2
SCHEMBL14216306 0.87 SYK (0.70) SYKZAP70SRCCDK2JAK2
SCHEMBL14216134 0.87 SYK (0.73) SYKZAP70SRCCDK2JAK2
SCHEMBL14216056 0.87 SYK (0.66) SYKZAP70SRCCDK2JAK2
SCHEMBL15668071 0.86 SYK (1.00) SYKZAP70SRCCDK2JAK2
SCHEMBL15668072 0.86 SYK (1.00) SYKZAP70SRCCDK2JAK2
SCHEMBL14216051 0.85 ZAP70 (0.67) SYKZAP70SRCCDK2KDM4E
SCHEMBL14216156 0.83 SYK (0.65) SYKZAP70SRCCDK2JAK2
SCHEMBL14216202 0.83 SYK (0.67) 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