SCHEMBL14216294

SCHEMBL14216294

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

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 15/20 0.77
ZAP70 P43403 14/20 0.77
SRC P12931 14/20 0.77
CDK2 P24941 9/20 0.77
KDR P35968 1/20 0.48
CDK4 P11802 3/20 0.47
GSK3B P49841 1/20 0.47
AURKA O14965 1/20 0.45
CDK1 P06493 1/20 0.45
CDK7 P50613 1/20 0.45
CDK9 P50750 1/20 0.45
ABL1 P00519 1/20 0.44
BCR P11274 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
SCHEMBL14216119 0.85 SYK (0.77) SYKZAP70SRCCDK2KDR
SCHEMBL14216022 0.84 SYK (0.79) SYKZAP70SRCCDK2KDR
SCHEMBL144714 0.82 SYK (0.64) SYKZAP70SRCCDK2KDR
SCHEMBL5038586 0.81 SYK (1.00) SYKZAP70SRCCDK2CDK4
SCHEMBL5034160 0.81 SYK (0.72) SYKZAP70SRCCDK2KDR
SCHEMBL5034149 0.81 SYK (0.72) SYKZAP70SRCCDK2KDR
SCHEMBL5037349 0.81 SYK (0.79) SYKZAP70SRCCDK2CDK4
SCHEMBL13924509 0.80 SYK (1.00) SYKZAP70SRCCDK2
SCHEMBL5036868 0.80 SYK (0.76) SYKZAP70SRCCDK2CDK4
SCHEMBL14216163 0.80 SYK (0.76) SYKZAP70SRCCDK2CDK4

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 1 patent. 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