SCHEMBL5481891

SCHEMBL5481891

N#Cc1cncc(-c2cccc([N+](=O)[O-])c2)c1Nc1ccc(OCc2ccccn2)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.56
STK3 Q13188 6/20 0.51
STK4 Q13043 5/20 0.51
PRKCQ Q04759 5/20 0.49
ERBB2 P04626 5/20 0.46
SRC P12931 2/20 0.45
KDR P35968 2/20 0.45
STK25 O00506 1/20 0.44
MAP2K7 O14733 1/20 0.44
CHEK1 O14757 1/20 0.44
GAK O14976 1/20 0.44
EPHB6 O15197 1/20 0.44
ABCC4 O15439 1/20 0.44
MAP3K13 O43283 1/20 0.44
NUAK1 O60285 1/20 0.44
STK17B O94768 1/20 0.44
STK10 O94804 1/20 0.44
PRKD3 O94806 1/20 0.44
ABCB11 O95342 1/20 0.44
MAP4K4 O95819 1/20 0.44

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
SCHEMBL4180838 0.90 EGFR (0.52) EGFRSTK4PRKCQERBB2
SCHEMBL4190265 0.80 EGFR (0.52) EGFRPRKCQERBB2
SCHEMBL4192096 0.76 EGFR (0.55) EGFRPRKCQERBB2
SCHEMBL28622133 0.74 STK3 (0.77) EGFRSTK3STK4ERBB2SRC
SCHEMBL2983759 0.73 PRKCQ (0.61) PRKCQLYN
SCHEMBL30218362 0.72 MAPT (0.58) EGFRERBB2ERBB3SYKERBB4
SCHEMBL215759 0.72 MAPT (0.58) EGFRERBB2ERBB3SYKERBB4
SCHEMBL29780767 0.72 MAPT (0.58) EGFRERBB2ERBB3SYKERBB4
SCHEMBL4191889 0.72 EGFR (0.57) EGFRPRKCQERBB2
SCHEMBL5469863 0.71 PRKCQ (0.69) EGFRPRKCQ

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-20070287738-A1 Substituted Cyanopyridines as protein kinase inhibitors WYETH 2007-12-13 US claimed
US-20070287738-A1 Substituted Cyanopyridines as protein kinase inhibitors WYETH 2007-12-13 US 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-20070287738-A1 Substituted Cyanopyridines as protein kinase inhibitors CNKSR1, MAP3K1, MAP3K6 EGFR 2704/4885STK3 139/4885STK4 62/4885

“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.