SCHEMBL1047853

SCHEMBL1047853

CC1(C)Oc2ccc(Nc3nc(Nc4ccccc4S(N)(=O)=O)cc4cc[nH]c(=O)c34)cc2NC1=O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 9/20 0.49
JAK1 P23458 3/20 0.48
JAK3 P52333 3/20 0.48
FER P16591 1/20 0.38
SYK P43405 9/20 0.38
JAK2 O60674 4/20 0.37
LYN P07948 4/20 0.37
KCNH2 Q12809 2/20 0.37
FLT3 P36888 1/20 0.37
BRD4 O60885 2/20 0.36
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 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
SCHEMBL1048250 0.77 ZAP70 (0.50) ZAP70FER
SCHEMBL1047072 0.76 ZAP70 (0.51) ZAP70JAK1FERSYKJAK2
SCHEMBL1046628 0.76 ZAP70 (0.60) ZAP70JAK1JAK3SYKJAK2
SCHEMBL1047387 0.76 ZAP70 (0.77) ZAP70JAK3SYKJAK2LYN
SCHEMBL1048578 0.76 ZAP70 (0.58) ZAP70JAK1JAK3FERSYK
SCHEMBL1049110 0.76 ZAP70 (0.68) ZAP70FERSYKJAK2LYN
SCHEMBL1048755 0.75 ZAP70 (0.58) ZAP70FERSYKJAK2LYN
SCHEMBL1045805 0.75 ZAP70 (0.58) ZAP70FERSYKJAK2LYN
SCHEMBL13753029 0.75 ZAP70 (0.48) ZAP70FERSYKJAK2LYN
SCHEMBL1048284 0.74 ZAP70 (0.51) ZAP70JAK1FERSYKJAK2

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 9 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
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
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
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 4/4885JAK1 90/4885JAK3 212/4885

“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.