SCHEMBL14216005

SCHEMBL14216005

Cc1cc(C)cc(Nc2nccc(-c3ncc(CN4CCCCC4)s3)n2)c1

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SYK P43405 18/20 0.69
ZAP70 P43403 11/20 0.69
SRC P12931 9/20 0.69
CDK2 P24941 5/20 0.62
FLT3 P36888 6/20 0.50
JAK2 O60674 5/20 0.47
LYN P07948 3/20 0.45
CDK4 P11802 1/20 0.44
GSK3B P49841 1/20 0.44
JAK3 P52333 1/20 0.44

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
SCHEMBL14216062 0.91 SYK (0.67) SYKZAP70SRCCDK2FLT3
SCHEMBL14215971 0.91 SYK (0.67) SYKZAP70SRCCDK2FLT3
SCHEMBL14215969 0.91 SYK (0.67) SYKZAP70SRCCDK2FLT3
SCHEMBL14216229 0.90 SYK (0.66) SYKZAP70SRCCDK2FLT3
SCHEMBL14216053 0.84 SYK (0.66) SYKZAP70SRCCDK2FLT3
SCHEMBL14216017 0.82 SYK (0.80) SYKZAP70SRCCDK2FLT3
SCHEMBL14216309 0.82 SYK (0.67) SYKZAP70SRCCDK2FLT3
SCHEMBL14378908 0.82 SYK (0.70) SYKZAP70SRCCDK2FLT3
SCHEMBL14216172 0.82 SYK (0.58) SYKZAP70SRCCDK2FLT3
SCHEMBL5036699 0.82 SYK (0.66) SYKZAP70SRCCDK2FLT3

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