SCHEMBL14216287

SCHEMBL14216287

Cc1cc(C)cc(Nc2nccc(-c3ncc(C#N)s3)n2)c1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SYK P43405 15/20 0.72
ZAP70 P43403 13/20 0.72
SRC P12931 11/20 0.72
CDK2 P24941 7/20 0.72
KDR P35968 1/20 0.48
CDK4 P11802 2/20 0.47
GSK3B P49841 1/20 0.47
ABL1 P00519 1/20 0.46
BCR P11274 1/20 0.46
PIK3CA P42336 1/20 0.43
PIK3CG P48736 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
SCHEMBL14216122 0.84 ZAP70 (1.00) SYKZAP70SRCCDK2KDR
SCHEMBL14216203 0.81 SYK (0.77) SYKZAP70SRCCDK2KDR
SCHEMBL14216024 0.81 ZAP70 (0.77) SYKZAP70SRCCDK2KDR
SCHEMBL14216198 0.81 ZAP70 (0.77) SYKZAP70SRCCDK2KDR
SCHEMBL14216017 0.80 SYK (0.80) SYKZAP70SRCCDK2KDR
SCHEMBL5043703 0.80 SYK (0.73) SYKZAP70SRCCDK2KDR
SCHEMBL5034149 0.79 SYK (0.72) SYKZAP70SRCCDK2KDR
SCHEMBL14216160 0.79 SYK (1.00) SYKZAP70SRCCDK2CDK4
SCHEMBL14216081 0.79 ZAP70 (0.88) SYKZAP70SRCCDK2KDR
SCHEMBL14216274 0.78 SYK (0.77) SYKZAP70SRCCDK2KDR

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