SCHEMBL4191889

SCHEMBL4191889

COc1cccc(-c2cncc(C#N)c2Nc2cccc([N+](=O)[O-])c2)c1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.57
ERBB2 P04626 1/20 0.57
PRKCQ Q04759 13/20 0.54
PRKCD Q05655 2/20 0.53
ABCG2 Q9UNQ0 4/20 0.50
PDE4B Q07343 1/20 0.46
PRKCH P24723 1/20 0.45
PRKCE Q02156 1/20 0.45

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
SCHEMBL4199369 0.88 PRKCQ (0.64) PRKCQPRKCDPDE4BPRKCHPRKCE
SCHEMBL4194592 0.83 PRKCQ (0.76) EGFRERBB2PRKCQPRKCDABCG2
SCHEMBL4193621 0.82 EGFR (0.51) EGFRERBB2PRKCQABCG2
SCHEMBL5473022 0.81 PRKCQ (0.65) PRKCQPRKCDABCG2PRKCHPRKCE
SCHEMBL4182703 0.80 PRKCQ (0.60) PRKCQPRKCDPRKCHPRKCE
SCHEMBL4196893 0.78 PRKCQ (0.60) PRKCQPRKCDPRKCHPRKCE
SCHEMBL4190265 0.78 EGFR (0.52) EGFRERBB2PRKCQ
SCHEMBL2983759 0.77 PRKCQ (0.61) PRKCQPRKCDPRKCHPRKCE
SCHEMBL2985945 0.76 PRKCQ (0.59) PRKCQPRKCDPRKCHPRKCE
SCHEMBL2980130 0.76 PRKCQ (0.57) PRKCQPRKCDPRKCHPRKCE

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 4 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
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 2704/4885ERBB2 1345/4885PRKCQ 166/4885

“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.