SCHEMBL1355679

SCHEMBL1355679

COc1ccc(-n2ncc3cnc(Nc4ccc(N5CCN(S(C)(=O)=O)CC5)cc4)nc32)cc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FGFR4 P22455 6/20 0.56
EIF2AK4 Q9P2K8 1/20 0.56
JAK2 O60674 3/20 0.54
JAK3 P52333 3/20 0.54
EGFR P00533 1/20 0.51
KDR P35968 1/20 0.51
BRD4 O60885 1/20 0.50
TBK1 Q9UHD2 1/20 0.50
FLT3 P36888 1/20 0.49
SYK P43405 2/20 0.49
JAK1 P23458 1/20 0.49
AURKA O14965 2/20 0.48
CDK4 P11802 1/20 0.48
TTK P33981 1/20 0.47
KCNH2 Q12809 1/20 0.47
ALK Q9UM73 1/20 0.47
CDK2 P24941 1/20 0.47
CDK9 P50750 1/20 0.47
AURKB Q96GD4 1/20 0.47

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
SCHEMBL1353747 0.91 AURKA (0.58) FGFR4JAK2JAK3EGFRKDR
SCHEMBL1355729 0.89 FGFR4 (0.50) FGFR4EIF2AK4JAK2JAK3EGFR
SCHEMBL1353760 0.87 EGFR (0.65) FGFR4EIF2AK4EGFRKDRBRD4
SCHEMBL1355752 0.86 EIF2AK4 (0.62) FGFR4EIF2AK4EGFRKDRTBK1
SCHEMBL1355170 0.85 EIF2AK4 (0.61) FGFR4EIF2AK4EGFRKDRTBK1
SCHEMBL1353701 0.84 EIF2AK4 (0.60) FGFR4EIF2AK4EGFRKDRBRD4
SCHEMBL1356098 0.84 EIF2AK4 (0.62) FGFR4EIF2AK4JAK2JAK3EGFR
SCHEMBL1355988 0.84 FLT3 (0.64) FGFR4EIF2AK4JAK2JAK3EGFR
SCHEMBL1353780 0.82 EIF2AK4 (0.60) FGFR4EIF2AK4JAK2JAK3EGFR
SCHEMBL1355792 0.82 EIF2AK4 (0.57) FGFR4EIF2AK4JAK2JAK3BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110281821-A9 Modulators of Mitotic Kinases BIOGEN IDEC MA INC. (US) 2011-11-17 US claimed
US-20100249067-A1 Modulators of Mitotic Kinases BIOGEN IDEC MA INC. (US) 2010-09-30 US claimed
US-20110281821-A9 Modulators of Mitotic Kinases BIOGEN IDEC MA INC. (US) 2011-11-17 US disclosed
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 (2 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 FGFR4 1543/4885EIF2AK4 791/4885JAK2 1365/4885
US-20110281821-A9 Modulators of Mitotic Kinases BUB1, BUB1B, CDK1 FGFR4 1543/4885EIF2AK4 791/4885JAK2 1365/4885

“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.