SCHEMBL4392479

SCHEMBL4392479

O=C(CO)N1CCC(COc2cccc3ncnc(Nc4ccc(OCc5nccs5)c(Cl)c4)c23)CC1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 16/20 0.60
EGFR P00533 15/20 0.60
KCNH2 Q12809 2/20 0.48
RIPK2 O43353 1/20 0.47
YES1 P07947 1/20 0.47
FECH P22830 1/20 0.47
ERBB4 Q15303 1/20 0.47
RIPK3 Q9Y572 1/20 0.47

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
SCHEMBL5696913 0.96 ERBB2 (0.58) ERBB2EGFRKCNH2RIPK2YES1
SCHEMBL4385327 0.87 ERBB2 (0.78) ERBB2EGFRKCNH2
SCHEMBL4389133 0.86 EGFR (0.65) ERBB2EGFRKCNH2
SCHEMBL4383941 0.85 EGFR (0.64) ERBB2EGFRERBB4
SCHEMBL4387599 0.85 ERBB2 (0.58) ERBB2EGFRKCNH2
SCHEMBL4385319 0.84 ERBB2 (0.64) ERBB2EGFRKCNH2
SCHEMBL4544225 0.83 ERBB2 (0.76) ERBB2EGFRKCNH2
SCHEMBL5474732 0.83 ERBB2 (0.76) ERBB2EGFRKCNH2
SCHEMBL4396239 0.79 ERBB2 (0.79) ERBB2EGFRKCNH2
SCHEMBL4391670 0.79 ERBB2 (0.79) ERBB2EGFRKCNH2

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-20070015743-A1 Quinazoline derivatives as antitumor agents ASTRAZENECA AB (SE) 2007-01-18 US claimed
EP-1664029-B1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ASTRAZENECA AB (SE) 2009-12-02 EP disclosed
US-20070015743-A1 Quinazoline derivatives as antitumor agents ASTRAZENECA AB (SE) 2007-01-18 US disclosed
EP-1664029-A1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS AstraZeneca AB (SE) 2006-06-07 EP disclosed
WO-2005026152-A1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS 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-20070015743-A1 Quinazoline derivatives as antitumor agents ERBB2, ABL1, EGFR ERBB2 1/4885EGFR 3/4885KCNH2 3564/4885

“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.