SCHEMBL4180838

SCHEMBL4180838

N#Cc1cncc(-c2cccc([N+](=O)[O-])c2)c1Nc1ccc(OCc2ccccc2)c(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 10/20 0.52
PRKCQ Q04759 8/20 0.49
ERBB2 P04626 7/20 0.46
CYP19A1 P11511 1/20 0.44
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
STK4 Q13043 1/20 0.43

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
SCHEMBL5481891 0.90 EGFR (0.56) EGFRPRKCQERBB2STK4
SCHEMBL4192096 0.86 EGFR (0.55) EGFRPRKCQERBB2
SCHEMBL4190265 0.82 EGFR (0.52) EGFRPRKCQERBB2
SCHEMBL5469867 0.77 PRKCQ (0.72) PRKCQ
SCHEMBL5469863 0.76 PRKCQ (0.69) EGFRPRKCQ
SCHEMBL5470678 0.76 PRKCQ (0.69) EGFRPRKCQ
SCHEMBL4493784 0.75 PRKCQ (0.66) EGFRPRKCQ
SCHEMBL2983759 0.74 PRKCQ (0.61) PRKCQ
SCHEMBL4191889 0.74 EGFR (0.57) EGFRPRKCQERBB2
SCHEMBL4501776 0.73 PRKCQ (0.73) EGFRPRKCQERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2027093-A2 SUBSTITUTED CYANOPYRIDINES AS PROTEIN KINASE INHIBITORS Wyeth (US) 2009-02-25 EP claimed
WO-2007146323-A2 SUBSTITUTED CYANOPYRIDINES AS PROTEIN KINASE INHIBITORS WYETH (US) 2007-12-21 WO claimed
US-20070287738-A1 Substituted Cyanopyridines as protein kinase inhibitors WYETH 2007-12-13 US claimed
EP-2027093-A2 SUBSTITUTED CYANOPYRIDINES AS PROTEIN KINASE INHIBITORS Wyeth (US) 2009-02-25 EP disclosed
WO-2007146323-A2 SUBSTITUTED CYANOPYRIDINES AS PROTEIN KINASE INHIBITORS WYETH (US) 2007-12-21 WO disclosed
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 2704/4885PRKCQ 166/4885ERBB2 1345/4885

“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.