SCHEMBL6429537

SCHEMBL6429537

COCCOc1cc(OC2CCN(C)CC2)c2c(N(F)c3cccc(Cl)c3)ncnc2c1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.47
SRC P12931 11/20 0.45
KDR P35968 8/20 0.42
ERBB2 P04626 1/20 0.40
FGFR1 P11362 1/20 0.39
FLT1 P17948 1/20 0.39
CSF1R P07333 1/20 0.39

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
SCHEMBL6402918 0.83 EGFR (0.43) EGFRSRCKDRERBB2FGFR1
SCHEMBL6403835 0.81 SRC (0.54) EGFRSRCKDRERBB2FGFR1
SCHEMBL4033942 0.80 EGFR (0.56) EGFRSRCKDRCSF1R
SCHEMBL6405839 0.80 EGFR (0.49) EGFRSRCKDRERBB2
Trifluoroacetic Acid SCHEMBL6402916 0.79 EGFR (0.41) EGFRSRCKDRERBB2FGFR1
SCHEMBL6402072 0.78 EGFR (0.45) EGFRSRCKDRFGFR1
SCHEMBL4036214 0.74 EGFR (0.83) EGFRSRCKDRERBB2
SCHEMBL5475801 0.74 EGFR (0.54) EGFRSRCKDRERBB2FGFR1
SCHEMBL4046007 0.73 EGFR (0.59) EGFRSRCKDRERBB2
SCHEMBL4041360 0.72 EGFR (0.58) EGFRSRCKDRERBB2

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-20050054662-A1 Quinazoline derivatives as antitumor agents ASTRAZENECA AB (SE) 2005-03-10 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-20050054662-A1 Quinazoline derivatives as antitumor agents ERBB2, ERBB3, ABL1 EGFR 4/4885SRC 111/4885KDR 75/4885

“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.