SCHEMBL9911474

SCHEMBL9911474

CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(F)c4)c(C)c3)c2cc1NC(=O)C=C1CCNCC1

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGFR P00533 18/20 0.65
ERBB2 P04626 17/20 0.65
STK3 Q13188 1/20 0.55
STK4 Q13043 1/20 0.55

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
SCHEMBL9911524 0.94 EGFR (0.58) EGFRERBB2
SCHEMBL9911408 0.93 EGFR (0.57) EGFRERBB2
SCHEMBL12094779 0.93 EGFR (0.64) EGFRERBB2
SCHEMBL2950762 0.93 EGFR (0.75) EGFRERBB2
SCHEMBL12094793 0.92 EGFR (0.62) EGFRERBB2
SCHEMBL9911597 0.90 EGFR (0.61) EGFRERBB2
SCHEMBL12094751 0.90 EGFR (0.60) EGFRERBB2
SCHEMBL2942076 0.88 EGFR (0.67) EGFRERBB2
SCHEMBL9911364 0.88 EGFR (0.65) EGFRERBB2STK3STK4
SCHEMBL3605631 0.87 EGFR (0.66) EGFRERBB2

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-8198301-B2 Quinazoline and quinoline derivatives as irreversibe protein tyrosine kinase inhibitors TIANJIN HEMAY ONCOLOGY PHARMACEUTICAL CO., LTD. (CN) 2012-06-12 US disclosed
US-20100240649-A1 QUINAZOLINE AND QUINOLINE DERIVATIVES AS IRREVERSIBLE PROTEIN TYROSINE KINASE INHIBITORS TIANJIN HEMAY ONCOLOGY PHARMACEUTICAL CO., LTD. (CN) 2010-09-23 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-20100240649-A1 QUINAZOLINE AND QUINOLINE DERIVATIVES AS IRREVERSIBLE PROTEIN TYROSINE KINASE INHIBITORS ABL1, MAP3K7, MAP3K5 EGFR 621/4885ERBB2 170/4885STK3 90/4885

“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.