SCHEMBL6526413

SCHEMBL6526413

Cc1ccnc(Nc2cc3cc[nH]c(=O)c3c(N3CCCC3)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K12 Q12852 6/20 0.47
KARS1 Q15046 4/20 0.42
SYK P43405 4/20 0.41
TYK2 P29597 1/20 0.39
FER P16591 1/20 0.38
JAK2 O60674 1/20 0.37
ZAP70 P43403 1/20 0.37
DPP4 P27487 1/20 0.37
MAP4K4 O95819 1/20 0.37
ABL1 P00519 1/20 0.37
LCK P06239 1/20 0.37
FYN P06241 1/20 0.37
IGF1R P08069 1/20 0.37
LTK P29376 1/20 0.37
KDR P35968 1/20 0.37
MAP2K2 P36507 1/20 0.37
MAPK8 P45983 1/20 0.37
MAPK9 P45984 1/20 0.37
CLK2 P49760 1/20 0.37
GSK3A P49840 1/20 0.37

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
SCHEMBL1158395 0.91 ZAP70 (0.47) MAP3K12KARS1SYKZAP70
SCHEMBL1158575 0.85 SYK (0.44) MAP3K12KARS1SYKFER
SCHEMBL1159802 0.85 EGFR (0.39) MAP3K12TYK2JAK2ZAP70MAPK8
SCHEMBL1158226 0.83 SYK (0.42) MAP3K12KARS1SYK
SCHEMBL1158802 0.83 SYK (0.42) MAP3K12KARS1SYK
SCHEMBL1159218 0.78 FER (0.41) KARS1SYKTYK2FERJAK2
SCHEMBL1158573 0.78 FER (0.43) MAP3K12KARS1SYKTYK2FER
SCHEMBL1158606 0.77 SYK (0.54) MAP3K12SYKFERJAK2ZAP70
SCHEMBL1158890 0.77 SYK (0.54) MAP3K12SYKFERJAK2ZAP70
SCHEMBL1158647 0.77 SYK (0.56) MAP3K12SYKTYK2FERJAK2

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 MAP3K12 135/4885KARS1 2211/4885SYK 1/4885

“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.