SCHEMBL14216065

SCHEMBL14216065

COc1cccc(Nc2nccc(-c3ncc(C)s3)n2)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 7/20 0.69
SRC P12931 4/20 0.69
ZAP70 P43403 4/20 0.69
CDK2 P24941 5/20 0.65
PIK3CG P48736 5/20 0.64
PIK3CA P42336 4/20 0.64
PIK3CB P42338 4/20 0.64
EGFR P00533 1/20 0.59
GSK3B P49841 4/20 0.58
DYRK1A Q13627 2/20 0.58
CDK5 Q00535 2/20 0.58
JAK2 O60674 2/20 0.58
CDC7 O00311 1/20 0.58
PLK4 O00444 1/20 0.58
IKBKB O14920 1/20 0.58
AURKA O14965 1/20 0.58
CHUK O15111 1/20 0.58
MAPK13 O15264 1/20 0.58
DAPK3 O43293 1/20 0.58
DYRK3 O43781 1/20 0.58

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
SCHEMBL14216010 0.89 SYK (0.68) SYKSRCZAP70CDK2PIK3CG
SCHEMBL14378897 0.86 SRC (0.68) SYKSRCZAP70CDK2PIK3CG
SCHEMBL14216222 0.86 CDK2 (0.79) SYKSRCZAP70CDK2PIK3CG
SCHEMBL14216157 0.85 SYK (0.70) SYKSRCZAP70CDK2PIK3CG
SCHEMBL7468136 0.85 PIK3CG (0.68) SYKSRCZAP70CDK2PIK3CG
SCHEMBL14216067 0.84 SRC (0.72) SYKSRCZAP70CDK2EGFR
SCHEMBL14216006 0.83 SYK (0.74) SYKSRCZAP70CDK2EGFR
SCHEMBL14378874 0.83 ZAP70 (0.67) SYKSRCZAP70CDK2PIK3CG
SCHEMBL14216079 0.83 CDK2 (0.67) SYKSRCZAP70CDK2PIK3CG
SCHEMBL14216070 0.83 SRC (0.67) SYKSRCZAP70CDK2JAK2

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