SCHEMBL5664663

SCHEMBL5664663

COCCN(C)CCCOc1cc(OC2CCOCC2)c2c(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)ncnc2c1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.65
ERBB2 P04626 7/20 0.60
GAK O14976 1/20 0.49
SRC P12931 2/20 0.48
KDR P35968 2/20 0.48
ERBB3 P21860 1/20 0.48
ERBB4 Q15303 1/20 0.48

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
SCHEMBL4206618 0.94 EGFR (0.61) EGFRERBB2GAKSRCKDR
Hydrochloric Acid SCHEMBL4039545 0.94 EGFR (0.61) EGFRERBB2GAKERBB3ERBB4
SCHEMBL4032243 0.92 EGFR (0.71) EGFRERBB2GAK
SCHEMBL4040512 0.89 EGFR (0.65) EGFRERBB2GAKERBB3ERBB4
SCHEMBL4033372 0.89 EGFR (0.65) EGFRERBB2GAKERBB3ERBB4
SCHEMBL4031352 0.88 EGFR (0.70) EGFRERBB2GAKSRCKDR
SCHEMBL4034040 0.88 EGFR (0.83) EGFRSRCKDR
SCHEMBL4038463 0.87 EGFR (0.78) EGFRERBB2GAKSRCKDR
SCHEMBL4036145 0.87 EGFR (0.65) EGFRERBB2GAKERBB3ERBB4
SCHEMBL4032406 0.86 EGFR (0.73) EGFRERBB2GAKSRCKDR

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-20070088044-A1 Quinazoline derivatives as antitumor agents ASTRAZENECA AB 2007-04-19 US disclosed
US-20050054662-A1 Quinazoline derivatives as antitumor agents ASTRAZENECA AB (SE) 2005-03-10 US disclosed
EP-1444211-A2 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS AstraZeneca AB (SE) 2004-08-11 EP disclosed
WO-2003040109-A2 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ASTRAZENECA AB (SE) 2003-05-15 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 (2 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-20050054662-A1 Quinazoline derivatives as antitumor agents ERBB2, ERBB3, ABL1 EGFR 4/4885ERBB2 1/4885GAK 178/4885
US-20070088044-A1 Quinazoline derivatives as antitumor agents ERBB2, EGFR, ERBB4 EGFR 2/4885ERBB2 1/4885GAK 99/4885

“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.