SCHEMBL6519251

SCHEMBL6519251

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

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SYK P43405 6/20 0.40
TYK2 P29597 4/20 0.34
MAP3K12 Q12852 2/20 0.31
MASTL Q96GX5 3/20 0.31
MAP2K1 Q02750 2/20 0.31
GRM2 Q14416 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
SCHEMBL1159250 0.93 SYK (0.41) SYKTYK2MAP3K12MASTLGRM2
SCHEMBL1158643 0.92 SYK (0.41) SYKTYK2MAP3K12MASTLGRM2
SCHEMBL1159717 0.91 SYK (0.39) SYKTYK2MAP3K12MASTLMAP2K1
SCHEMBL1158537 0.91 SYK (0.42) SYKTYK2MAP3K12MASTLGRM2
SCHEMBL1159637 0.91 SYK (0.41) SYKMAP3K12
SCHEMBL1159228 0.91 SYK (0.40) SYKTYK2MAP3K12MASTLMAP2K1
SCHEMBL1158681 0.89 SYK (0.39) SYKTYK2MAP3K12MASTL
SCHEMBL1158692 0.89 SYK (0.39) SYKTYK2MASTLGRM2
SCHEMBL1158733 0.89 SYK (0.40) SYKMAP3K12MASTL
SCHEMBL6520463 0.89 SYK (0.39) SYKTYK2MAP3K12MAP2K1

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 1/4885TYK2 35/4885MAP3K12 135/4885

“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.