SCHEMBL5069437

SCHEMBL5069437

NS(=O)(=O)c1ccc(Nc2nc3ncnc(Nc4cccc(CN5CCOCC5)c4)c3s2)cc1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.70
CDK1 P06493 1/20 0.56
TBK1 Q9UHD2 3/20 0.55
CSF1R P07333 2/20 0.55
TYK2 P29597 2/20 0.55
NTRK1 P04629 2/20 0.55
NUAK1 O60285 1/20 0.55
STK16 O75716 1/20 0.55
CSNK2A2 P19784 1/20 0.55
AAK1 Q2M2I8 1/20 0.55
ULK3 Q6PHR2 1/20 0.55
BMP2K Q9NSY1 1/20 0.55
ULK2 Q8IYT8 1/20 0.55
IKBKE Q14164 1/20 0.52
JAK2 O60674 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
SCHEMBL5066746 0.85 EGFR (0.74) EGFRCDK1
SCHEMBL14461569 0.85 EGFR (0.76) EGFR
SCHEMBL13672658 0.83 EGFR (0.79) EGFR
SCHEMBL13675165 0.83 EGFR (0.71) EGFR
SCHEMBL13672602 0.83 EGFR (0.87) EGFR
SCHEMBL5067329 0.82 EGFR (1.00) EGFRCDK1JAK2JAK3
SCHEMBL13675243 0.82 EGFR (0.77) EGFR
SCHEMBL14461354 0.81 EGFR (0.69) EGFR
SCHEMBL5063878 0.81 EGFR (1.00) EGFRCDK1
SCHEMBL13672633 0.80 EGFR (1.00) EGFR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1912639-A2 THIAZOLOPYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-04-23 EP disclosed
WO-2007019191-A2 THIAZOLOPYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-02-15 WO disclosed