SCHEMBL1049269

SCHEMBL1049269

CNS(=O)(=O)c1ccccc1Nc1nc(-c2cncc(OC)c2)cc2cc[nH]c(=O)c12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 14/20 0.55
ULK1 O75385 2/20 0.39
CDC7 O00311 1/20 0.39
PLK4 O00444 1/20 0.39
CHEK1 O14757 1/20 0.39
AURKA O14965 1/20 0.39
DCLK1 O15075 1/20 0.39
MAPK13 O15264 1/20 0.39
PDPK1 O15530 1/20 0.39
DYRK3 O43781 1/20 0.39
JAK2 O60674 1/20 0.39
ROCK2 O75116 1/20 0.39
RPS6KA5 O75582 1/20 0.39
PRKD3 O94806 1/20 0.39
MAP4K4 O95819 1/20 0.39
PAK4 O96013 1/20 0.39
CHEK2 O96017 1/20 0.39
ABL1 P00519 1/20 0.39
EGFR P00533 1/20 0.39
ERBB2 P04626 1/20 0.39

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
SCHEMBL1082783 0.89 ZAP70 (0.55) ZAP70DCLK1EGFRINSRMET
SCHEMBL1082785 0.87 ZAP70 (0.53) ZAP70NTRK1SYKTTK
SCHEMBL1048823 0.84 ZAP70 (0.59) ZAP70
SCHEMBL12928958 0.77 ZAP70 (0.43) ZAP70DCLK1INSRCDK7CDK9
SCHEMBL15290705 0.76 ZAP70 (0.42) ZAP70DCLK1INSRMETCDK7
SCHEMBL1045549 0.76 ZAP70 (0.66) ZAP70JAK2TYK2PTK2DYRK1A
SCHEMBL1043361 0.75 ZAP70 (0.59) ZAP70PLK1CSNK2A1PTK2SYK
SCHEMBL1048924 0.73 ZAP70 (0.60) ZAP70TYK2PTK2DYRK1ASYK
SCHEMBL1082786 0.72 ZAP70 (0.66) ZAP70SYK
SCHEMBL12960918 0.72 ZAP70 (0.75) ZAP70FYNDYRK1A

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 2 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

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 4/4885ULK1 1578/4885CDC7 429/4885

“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.