SCHEMBL6522975

SCHEMBL6522975

CC(C)(C)Nc1nc(Nc2cc(C(=O)O)ccn2)cc2ccn(CCO)c(=O)c12

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SYK P43405 8/20 0.41
KDM4D Q6B0I6 2/20 0.38
JMJD6 Q6NYC1 1/20 0.32
NTRK1 P04629 3/20 0.32
KDM5A P29375 3/20 0.32
KDM4C Q9H3R0 3/20 0.32
KDM5B Q9UGL1 3/20 0.32
ADORA3 P0DMS8 1/20 0.31
ADORA1 P30542 1/20 0.31
TYK2 P29597 1/20 0.31
KDM2B Q8NHM5 1/20 0.31
EGLN1 Q9GZT9 1/20 0.30

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
SCHEMBL1159345 0.93 SYK (0.41) SYKNTRK1TYK2
SCHEMBL1158718 0.92 SYK (0.41) SYKNTRK1
SCHEMBL6523241 0.91 SYK (0.39) SYKNTRK1TYK2
SCHEMBL1159011 0.89 SYK (0.39) SYK
SCHEMBL6520120 0.89 SYK (0.39) SYK
SCHEMBL6520139 0.89 SYK (0.39) SYK
SCHEMBL6520133 0.89 SYK (0.39) SYK
SCHEMBL1158393 0.88 SYK (0.42) SYKTYK2
SCHEMBL1159007 0.88 SYK (0.40) SYK
SCHEMBL1159005 0.88 SYK (0.40) SYK

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 SYK 1/4885KDM4D 2164/4885JMJD6 1068/4885

“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.