SCHEMBL5490924

SCHEMBL5490924

Oc1ccc(Nc2ncnc3cccc(OCC4CCCCN4)c23)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 13/20 0.48
EGFR P00533 11/20 0.48
KCNH2 Q12809 2/20 0.43
EPHA2 P29317 3/20 0.42
KDR P35968 3/20 0.42
EPHB4 P54760 3/20 0.42
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41

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
SCHEMBL4389651 1.00 ERBB2 (0.48) ERBB2EGFRKCNH2EPHA2KDR
SCHEMBL4384923 1.00 ERBB2 (0.48) ERBB2EGFRKCNH2EPHA2KDR
SCHEMBL4387060 0.97 ERBB2 (0.48) ERBB2EGFRKCNH2EPHA2KDR
SCHEMBL4385924 0.97 ERBB2 (0.48) ERBB2EGFRKCNH2EPHA2KDR
SCHEMBL4385024 0.90 ERBB2 (0.43) ERBB2EGFRKCNH2
SCHEMBL27669572 0.87 EGFR (0.42) ERBB2EGFR
SCHEMBL4388217 0.87 CHRNB2 (0.45) ERBB2EGFRKCNH2
SCHEMBL4394507 0.87 CHRNB2 (0.45) ERBB2EGFRKCNH2
SCHEMBL4393432 0.85 EGFR (0.48) ERBB2EGFRKCNH2EPHA2KDR
SCHEMBL4382691 0.84 ERBB2 (0.68) 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 1 patent. 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 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.