SCHEMBL4484086

SCHEMBL4484086

C=CCN(C)C[C@@H](C)Oc1cccc2ncnc(Nc3ccc(O)c(C)c3)c12

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 20/20 0.50
KCNH2 Q12809 9/20 0.49
EGFR P00533 6/20 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
SCHEMBL4476272 0.91 ERBB2 (0.57) ERBB2KCNH2EGFR
SCHEMBL3812471 0.89 ERBB2 (0.61) ERBB2KCNH2EGFR
SCHEMBL27627667 0.89 ERBB2 (0.61) ERBB2KCNH2EGFR
SCHEMBL4476522 0.84 ERBB2 (0.69) ERBB2KCNH2EGFR
SCHEMBL4464734 0.84 ERBB2 (0.69) ERBB2KCNH2EGFR
SCHEMBL4476182 0.84 ERBB2 (0.67) ERBB2KCNH2EGFR
SCHEMBL4480924 0.84 ERBB2 (0.50) ERBB2KCNH2EGFR
SCHEMBL3808187 0.84 ERBB2 (0.50) ERBB2KCNH2EGFR
SCHEMBL27647886 0.84 ERBB2 (0.50) ERBB2KCNH2EGFR
SCHEMBL4483931 0.80 ERBB2 (0.52) 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 2 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

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.