SCHEMBL4031617

SCHEMBL4031617

Fc1ccc(Nc2ncnc3cc(OCCCN4CCNCC4)cc(OC4CCOC4)c23)cc1Cl

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGFR P00533 13/20 0.78
SRC P12931 8/20 0.63
KDR P35968 8/20 0.63
LCK P06239 1/20 0.55
YES1 P07947 1/20 0.55
FGFR1 P11362 1/20 0.55
CSK P41240 1/20 0.55
AURKB Q96GD4 1/20 0.55
ERBB2 P04626 1/20 0.54
RET P07949 1/20 0.54
MST1R Q04912 1/20 0.54
ERBB4 Q15303 1/20 0.54

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
SCHEMBL4040743 0.94 EGFR (0.84) EGFRSRCKDRLCKYES1
SCHEMBL4033940 0.94 EGFR (0.81) EGFRSRCKDRLCKYES1
SCHEMBL4034224 0.93 EGFR (0.80) EGFRSRCKDRLCKYES1
SCHEMBL4037402 0.93 EGFR (0.80) EGFRSRCKDRLCKYES1
SCHEMBL4032976 0.93 EGFR (0.85) EGFRSRCKDRLCKYES1
SCHEMBL4036227 0.92 EGFR (0.92) EGFRSRCKDRLCKYES1
SCHEMBL4037003 0.92 EGFR (0.71) EGFRSRCKDRLCKYES1
SCHEMBL5662033 0.92 EGFR (0.78) EGFRSRCKDRLCKYES1
SCHEMBL4042282 0.91 EGFR (0.82) EGFRSRCKDR
SCHEMBL4040837 0.90 EGFR (0.75) EGFRSRCKDRLCKYES1

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
EP-1444211-B1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ASTRAZENECA AB (SE) 2009-01-21 EP disclosed
US-20070088044-A1 Quinazoline derivatives as antitumor agents ASTRAZENECA AB 2007-04-19 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 (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-20070088044-A1 Quinazoline derivatives as antitumor agents ERBB2, EGFR, ERBB4 EGFR 2/4885SRC 39/4885KDR 33/4885

“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.