SCHEMBL6526409

SCHEMBL6526409

C[C@@H](O)CNc1nc(Nc2cnccn2)cc2ccn(C)c(=O)c12

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SYK P43405 15/20 0.47
LYN P07948 1/20 0.36
SRC P12931 1/20 0.36
BTK Q06187 1/20 0.36
ZAP70 P43403 1/20 0.35
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
TYK2 P29597 1/20 0.34
JAK3 P52333 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
SCHEMBL1158645 0.86 SYK (0.46) SMN1; SMN2SYKTYK2
SCHEMBL1158697 0.85 SYK (0.48) SYKLYNSRCBTK
SCHEMBL1158339 0.85 SYK (0.58) SYKZAP70JAK2JAK1TYK2
SCHEMBL1159276 0.84 SYK (0.54) SYKLYNSRCBTKZAP70
SCHEMBL1158780 0.83 SYK (0.49) KDM4EALDH1A1SMN1; SMN2SYKLYN
SCHEMBL1158670 0.83 SYK (0.43) SYKLYNSRCBTKZAP70
SCHEMBL1158882 0.81 SYK (0.46) SMN1; SMN2SYKLYNSRCBTK
SCHEMBL1158397 0.80 SYK (0.45) SMN1; SMN2SYKLYNSRCBTK
SCHEMBL1158451 0.79 SYK (0.66) SYKJAK3
SCHEMBL12795819 0.79 SYK (0.44) KDM4EALDH1A1SMN1; SMN2SYKLYN

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 KDM4E 1659/4885ALDH1A1 4436/4885SMN1; SMN2 3685/4885

“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.