SCHEMBL4488752

SCHEMBL4488752

CC(=O)NC[C@@H](C)Oc1cccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(C)c3)c12

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 15/20 0.52
EGFR P00533 8/20 0.51
MKNK2 Q9HBH9 3/20 0.51
KCNH2 Q12809 3/20 0.49

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
SCHEMBL4485337 0.92 ERBB2 (0.51) ERBB2EGFRKCNH2
SCHEMBL4476481 0.85 ERBB2 (0.64) ERBB2EGFRKCNH2
SCHEMBL4483931 0.84 ERBB2 (0.52) ERBB2EGFRMKNK2KCNH2
SCHEMBL4483658 0.84 ERBB2 (0.53) ERBB2EGFRKCNH2
SCHEMBL4478266 0.84 ERBB2 (0.54) ERBB2EGFRKCNH2
SCHEMBL13611876 0.82 ERBB2 (0.49) ERBB2EGFRMKNK2KCNH2
SCHEMBL4480007 0.79 ERBB2 (0.67) ERBB2EGFRKCNH2
SCHEMBL4485874 0.79 ERBB2 (0.55) ERBB2EGFRMKNK2KCNH2
SCHEMBL4482589 0.78 ERBB2 (0.64) ERBB2EGFRKCNH2
SCHEMBL3812931 0.77 ERBB2 (0.71) 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7625908-B2 Quinazoline derivatives ASTRAZENECA AB (SE) 2009-12-01 US claimed
US-20070244136-A1 Quinazoline Derivatives ASTRAZENECA AB (SE) 2007-10-18 US claimed
US-7625908-B2 Quinazoline derivatives ASTRAZENECA AB (SE) 2009-12-01 US disclosed
US-7625908-B2 Quinazoline derivatives ASTRAZENECA AB (SE) 2009-12-01 US disclosed
US-7625908-B2 Quinazoline derivatives ASTRAZENECA AB (SE) 2009-12-01 US disclosed
US-20070244136-A1 Quinazoline Derivatives ASTRAZENECA AB (SE) 2007-10-18 US disclosed
US-20070244136-A1 Quinazoline Derivatives ASTRAZENECA AB (SE) 2007-10-18 US disclosed
US-20070244136-A1 Quinazoline Derivatives ASTRAZENECA AB (SE) 2007-10-18 US disclosed
EP-1685116-A1 QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2006-08-02 EP disclosed
WO-2005051923-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2005-06-09 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-20070244136-A1 Quinazoline Derivatives ERBB2, ABL1, MKI67 ERBB2 1/4885EGFR 10/4885MKNK2 308/4885

“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.