SCHEMBL5566166

SCHEMBL5566166

O=C(CO)N1CC[C@H](Oc2ccc3ncnc(Nc4ccc(OCc5ccccn5)c(Cl)c4)c3c2)C1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.67
ERBB2 P04626 13/20 0.60
LCK P06239 1/20 0.60
KCNH2 Q12809 1/20 0.57
AURKA O14965 1/20 0.52
RPS6KB1 P23443 1/20 0.52

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
SCHEMBL6017179 0.96 EGFR (0.62) EGFRERBB2LCKKCNH2AURKA
SCHEMBL5564331 0.96 EGFR (0.62) EGFRERBB2LCKKCNH2AURKA
SCHEMBL5567987 0.96 EGFR (0.63) EGFRERBB2LCKKCNH2AURKA
SCHEMBL5569168 0.94 EGFR (0.64) EGFRERBB2LCKKCNH2AURKA
SCHEMBL5567889 0.89 EGFR (0.63) EGFRERBB2LCKKCNH2
SCHEMBL6017201 0.89 EGFR (0.63) EGFRERBB2LCKKCNH2
SCHEMBL5564685 0.89 EGFR (0.67) EGFRERBB2LCKKCNH2AURKA
SCHEMBL5568824 0.88 EGFR (0.65) EGFRERBB2LCKKCNH2AURKA
SCHEMBL5564723 0.88 EGFR (0.63) EGFRERBB2LCKKCNH2
SCHEMBL5697308 0.87 ERBB2 (0.76) EGFRERBB2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070032508-A1 Quinazoline derivatives as tyrosine kinase inhibitors ASTRAZENECA AB (SE) 2007-02-08 US claimed
US-20070032508-A1 Quinazoline derivatives as tyrosine kinase inhibitors ASTRAZENECA AB (SE) 2007-02-08 US disclosed
US-20070032508-A1 Quinazoline derivatives as tyrosine kinase inhibitors ASTRAZENECA AB (SE) 2007-02-08 US disclosed
EP-1664028-A1 QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS AstraZeneca AB (SE) 2006-06-07 EP disclosed
WO-2005026151-A1 QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2005-03-24 WO 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-20070032508-A1 Quinazoline derivatives as tyrosine kinase inhibitors ABL1, ERBB2, LCK EGFR 15/4885ERBB2 2/4885LCK 3/4885

“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.