SCHEMBL1049221

SCHEMBL1049221

COCCN1CCC(c2ccc(Nc3nc(Nc4cccc(C)c4S(N)(=O)=O)cc4cc[nH]c(=O)c34)cc2C)CC1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 12/20 0.61
FER P16591 1/20 0.41
ALK Q9UM73 5/20 0.39
JAK2 O60674 3/20 0.38
LYN P07948 3/20 0.38
SYK P43405 3/20 0.38
INSR P06213 2/20 0.38
KCNH2 Q12809 2/20 0.38
IGF1R P08069 1/20 0.36
CYP3A4 P08684 1/20 0.36
FLT3 P36888 1/20 0.35
BRD4 O60885 1/20 0.35
ATAD2 Q6PL18 1/20 0.35

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
SCHEMBL1047783 0.86 ZAP70 (0.65) ZAP70FERALKJAK2LYN
SCHEMBL1045756 0.85 ZAP70 (0.60) ZAP70FERALKJAK2LYN
SCHEMBL1045772 0.83 ZAP70 (0.67) ZAP70FERALKJAK2LYN
SCHEMBL1046734 0.82 ZAP70 (0.71) ZAP70FERJAK2LYNSYK
SCHEMBL1159759 0.80 ZAP70 (0.64) ZAP70SYKBRD4ATAD2
SCHEMBL1048183 0.80 ZAP70 (0.69) ZAP70FERJAK2LYNSYK
SCHEMBL1158486 0.79 ZAP70 (0.61) ZAP70JAK2SYKBRD4ATAD2
SCHEMBL1045873 0.79 ZAP70 (0.62) ZAP70FERALKIGF1RCYP3A4
SCHEMBL1048278 0.77 ZAP70 (0.56) ZAP70FERALKSYKINSR
SCHEMBL1048447 0.77 ZAP70 (0.68) ZAP70JAK2SYKBRD4ATAD2

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US claimed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US claimed
EP-2238137-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2010-10-13 EP claimed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 WO claimed
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
CN-101990539-A Compounds and compositions as kinase inhibitors IRM LLC 2011-03-23 CN disclosed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US disclosed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US disclosed
US-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2011-01-06 US disclosed
EP-2238137-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2010-10-13 EP disclosed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 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-20110003798-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FYN, SYK, RET ZAP70 4/4885FER 7/4885ALK 9/4885

“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.