SCHEMBL6524873

SCHEMBL6524873

Cc1ccnc(Nc2cc3cc[nH]c(=O)c3c(N[C@@H]3CCC[C@H]3O)n2)c1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FER P16591 3/20 0.50
SYK P43405 8/20 0.48
JAK2 O60674 5/20 0.46
JAK1 P23458 1/20 0.46
LYN P07948 4/20 0.42
ZAP70 P43403 4/20 0.42
KCNH2 Q12809 2/20 0.42
FLT3 P36888 1/20 0.37
MAP3K12 Q12852 5/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL1158570 1.00 FER (0.50) FERSYKJAK2JAK1LYN
SCHEMBL1158606 0.88 SYK (0.54) FERSYKJAK2JAK1LYN
SCHEMBL6522981 0.87 JAK2 (0.48) FERSYKJAK2JAK1LYN
SCHEMBL6519945 0.87 JAK2 (0.48) FERSYKJAK2JAK1LYN
SCHEMBL1158767 0.86 SYK (0.64) FERSYKJAK2LYNZAP70
SCHEMBL12795693 0.86 SYK (0.64) FERSYKJAK2LYNZAP70
SCHEMBL1158890 0.85 SYK (0.54) FERSYKJAK2JAK1LYN
SCHEMBL1158534 0.85 SYK (0.58) FERSYKJAK2LYNZAP70
SCHEMBL1158755 0.83 SYK (0.56) SYKMAP3K12KDM4EALDH1A1L3MBTL1
SCHEMBL1158617 0.82 SYK (0.49) FERSYKJAK2LYNZAP70

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 FER 89/4885SYK 1/4885JAK2 19/4885

“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.