SCHEMBL4479453

SCHEMBL4479453

COCC(=O)NC[C@@H](C)Oc1cccc2ncnc(Nc3ccc(O)c(Cl)c3)c12

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 20/20 0.52
KCNH2 Q12809 6/20 0.52
EGFR P00533 7/20 0.51

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
SCHEMBL4493777 0.92 ERBB2 (0.56) ERBB2KCNH2EGFR
SCHEMBL4485874 0.90 ERBB2 (0.55) ERBB2KCNH2EGFR
SCHEMBL4481509 0.89 ERBB2 (0.54) ERBB2KCNH2EGFR
SCHEMBL4492852 0.87 ERBB2 (0.56) ERBB2KCNH2EGFR
SCHEMBL4471971 0.86 ERBB2 (0.73) ERBB2KCNH2EGFR
SCHEMBL4477103 0.86 ERBB2 (0.73) ERBB2KCNH2EGFR
SCHEMBL3809425 0.83 ERBB2 (0.55) ERBB2KCNH2EGFR
SCHEMBL27627674 0.83 ERBB2 (0.55) ERBB2KCNH2EGFR
SCHEMBL4473084 0.82 ERBB2 (0.53) ERBB2KCNH2EGFR
SCHEMBL3817146 0.82 ERBB2 (0.69) ERBB2KCNH2EGFR

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
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
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 1/4885KCNH2 3674/4885EGFR 10/4885

“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.