SCHEMBL7565005

SCHEMBL7565005

O=C1CCC(C(=O)N2CCN(CCCCOc3cc4ncnc(Nc5ccc(F)c(Cl)c5)c4cc3[N+](=O)[O-])CC2)O1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.56
ERBB2 P04626 3/20 0.52
CIT O14578 2/20 0.51
GAK O14976 2/20 0.51
EPHB6 O15197 2/20 0.51
RIPK2 O43353 2/20 0.51
STK17B O94768 2/20 0.51
STK10 O94804 2/20 0.51
ABL1 P00519 2/20 0.51
LCK P06239 2/20 0.51
LYN P07948 2/20 0.51
RET P07949 2/20 0.51
MET P08581 2/20 0.51
HCK P08631 2/20 0.51
FGR P09769 2/20 0.51
KIT P10721 2/20 0.51
SRC P12931 2/20 0.51
EPHA1 P21709 2/20 0.51
ERBB3 P21860 2/20 0.51
EPHA3 P29320 2/20 0.51

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
SCHEMBL6998166 1.00 EGFR (0.56) EGFRERBB2CITGAKEPHB6
SCHEMBL7573128 0.98 EGFR (0.59) EGFRERBB2CITGAKEPHB6
SCHEMBL7004066 0.98 EGFR (0.59) EGFRERBB2CITGAKEPHB6
SCHEMBL7570637 0.96 EGFR (0.57) EGFR
SCHEMBL7570646 0.96 EGFR (0.57) EGFR
SCHEMBL7004230 0.90 EGFR (0.54) EGFRERBB2CITGAKEPHB6
SCHEMBL7572700 0.90 EGFR (0.54) EGFRERBB2CITGAKEPHB6
SCHEMBL7005585 0.88 EGFR (0.56) EGFRERBB2CITGAKEPHB6
SCHEMBL7566162 0.88 EGFR (0.56) EGFRERBB2CITGAKEPHB6
SCHEMBL5229068 0.87 EGFR (0.69) EGFRERBB2CITGAKEPHB6

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-20020082270-A1 Aminoquinazolines which inhibit signal transduction mediated by tyrosine kinases BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-06-27 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-20020082270-A1 Aminoquinazolines which inhibit signal transduction mediated by tyrosine kinases MAP3K1, MAP3K19, MAP3K20 EGFR 165/4885ERBB2 28/4885CIT 468/4885

“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.