SCHEMBL3605767

SCHEMBL3605767

CS(=O)(=O)CS(=O)(=O)Nc1ccc(Nc2ncc3cnn(-c4ccc(CC(N)=O)cc4)c3n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
WEE1 P30291 2/20 0.44
SRC P12931 1/20 0.44
EIF2AK4 Q9P2K8 1/20 0.41
FLT3 P36888 3/20 0.41
AURKA O14965 5/20 0.39
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39
JAK2 O60674 6/20 0.39
BRD4 O60885 6/20 0.39
JAK1 P23458 1/20 0.37
BRD2 P25440 1/20 0.37
JAK3 P52333 1/20 0.37
BRD3 Q15059 1/20 0.37
BRDT Q58F21 1/20 0.37
CDK1 P06493 4/20 0.37
CCNB1 P14635 4/20 0.37
STAT6 P42226 1/20 0.37
SYK P43405 1/20 0.36
NEK2 P51955 1/20 0.36

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
SCHEMBL1355490 0.84 EIF2AK4 (0.47) EIF2AK4FLT3AURKAGSK3AGSK3B
SCHEMBL1355845 0.83 EIF2AK4 (0.60) EIF2AK4FLT3AURKAJAK2JAK3
SCHEMBL1355918 0.83 EIF2AK4 (0.48) EIF2AK4FLT3AURKAGSK3AGSK3B
SCHEMBL1356177 0.81 EIF2AK4 (0.47) EIF2AK4FLT3AURKAGSK3AGSK3B
SCHEMBL3587383 0.75 DCLK1 (0.39) SRCEIF2AK4FLT3AURKAJAK2
SCHEMBL1355882 0.73 AURKA (0.46) EIF2AK4AURKAGSK3BCDK1CCNB1
SCHEMBL1355988 0.72 FLT3 (0.64) EIF2AK4FLT3AURKAJAK2JAK3
SCHEMBL3588130 0.72 AURKA (0.39) EIF2AK4FLT3AURKAJAK2JAK3
SCHEMBL27766949 0.72 MEN1 (0.51) SRCEIF2AK4FLT3JAK2JAK3
SCHEMBL3587399 0.71 AURKA (0.37) WEE1SRCFLT3AURKAJAK2

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
US-20100249067-A1 Modulators of Mitotic Kinases BIOGEN IDEC MA INC. (US) 2010-09-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100249067-A1 Modulators of Mitotic Kinases BUB1, BUB1B, CDK1 WEE1 104/4885SRC 311/4885EIF2AK4 791/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.