SCHEMBL6522981

SCHEMBL6522981

O=c1[nH]ccc2cc(Nc3ccccn3)nc(N[C@H]3CCC[C@H]3O)c12

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 8/20 0.48
JAK1 P23458 2/20 0.48
FER P16591 1/20 0.45
SYK P43405 13/20 0.42
LYN P07948 6/20 0.42
ZAP70 P43403 6/20 0.42
KCNH2 Q12809 2/20 0.42
FLT3 P36888 3/20 0.40
RET P07949 1/20 0.38
ALK Q9UM73 1/20 0.38
TYRO3 Q06418 1/20 0.35
MERTK Q12866 1/20 0.35
GAS6 Q14393 1/20 0.35
APAF1 O14727 1/20 0.34
TDP2 O95551 1/20 0.34
CDC25B P30305 1/20 0.34
CASP6 P55212 1/20 0.34
RCE1 Q9Y256 1/20 0.34

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
SCHEMBL6519945 1.00 JAK2 (0.48) JAK2JAK1FERSYKLYN
SCHEMBL6524873 0.87 FER (0.50) JAK2JAK1FERSYKLYN
SCHEMBL1158570 0.87 FER (0.50) JAK2JAK1FERSYKLYN
SCHEMBL1158642 0.85 FER (0.46) JAK2JAK1FERSYKLYN
SCHEMBL1158500 0.85 FER (0.43) JAK2JAK1FERSYKLYN
SCHEMBL1158431 0.80 ZAP70 (0.47) JAK2JAK1FERSYKLYN
SCHEMBL1158238 0.79 SYK (0.49) JAK2JAK1FERSYKLYN
SCHEMBL1158836 0.78 JAK2 (0.40) JAK2JAK1FERSYKLYN
SCHEMBL1159751 0.74 IRAK4 (0.35) JAK2JAK1FLT3TYRO3MERTK
SCHEMBL1158757 0.74 SYK (0.51) JAK2JAK1FERSYKLYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110053897-A1 COMPOUNDS AND COMPOSITIONS AS SYK KINASE INHIBITORS IRM LLC (BM) 2011-03-03 US claimed
US-20110053897-A1 COMPOUNDS AND COMPOSITIONS AS SYK KINASE INHIBITORS IRM LLC (BM) 2011-03-03 US disclosed
US-20110053897-A1 COMPOUNDS AND COMPOSITIONS AS SYK KINASE INHIBITORS IRM LLC (BM) 2011-03-03 US disclosed
US-20110053897-A1 COMPOUNDS AND COMPOSITIONS AS SYK KINASE INHIBITORS IRM LLC (BM) 2011-03-03 US disclosed
WO-2011014515-A1 2, 7 -NAPHTHYRIDIN- 1 -ONE DERIVATIVES AS SYK KINASE INHIBITORS IRM LLC (BM) 2011-02-03 WO 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-20110053897-A1 COMPOUNDS AND COMPOSITIONS AS SYK KINASE INHIBITORS SYK, BTK, LYN JAK2 19/4885JAK1 42/4885FER 89/4885

“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.