SCHEMBL6313281

SCHEMBL6313281

Cc1cccc(N(O)c2ncnc3cccc(OC4CCN(C)CC4)c23)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGFR P00533 12/20 0.48
ERBB2 P04626 4/20 0.48
SRC P12931 5/20 0.47
KCNH2 Q12809 1/20 0.43
CSF1R P07333 3/20 0.39
KDR P35968 2/20 0.38
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
PDE10A Q9Y233 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36

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
SCHEMBL5475801 0.89 EGFR (0.54) EGFRERBB2SRCKCNH2CSF1R
SCHEMBL4033919 0.82 EGFR (0.45) EGFRERBB2SRCKCNH2CSF1R
Hydrochloric Acid SCHEMBL5664057 0.81 EGFR (0.44) EGFRERBB2SRCKCNH2CSF1R
SCHEMBL6403835 0.78 SRC (0.54) EGFRERBB2SRCCSF1RKDR
Hydrochloric Acid SCHEMBL4034029 0.75 EGFR (0.70) EGFRERBB2SRCKCNH2KDR
SCHEMBL4029452 0.74 EGFR (0.60) EGFRERBB2SRCKCNH2KDR
SCHEMBL6621804 0.74 ERBB2 (0.41) EGFRERBB2SRCKCNH2KDR
SCHEMBL6312780 0.72 SRC (0.43) EGFRERBB2SRCCSF1RKDR
SCHEMBL6620697 0.71 SLC6A2 (0.42) EGFRERBB2SRCKCNH2KDR
SCHEMBL6619064 0.69 EGFR (0.45) EGFRERBB2SRCKCNH2KDR

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-20050043336-A1 Quinazoline derivatives as antitumor agents ASTRAZENECA AB (SE) 2005-02-24 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-20050043336-A1 Quinazoline derivatives as antitumor agents ERBB2, ERBB3, ABL1 EGFR 4/4885ERBB2 1/4885SRC 111/4885

“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.