SCHEMBL13404536

SCHEMBL13404536

COc1cc2ncnc(Nc3cc(Cl)c(C)cc3CN(C)C(C)C(C)=O)c2cc1O

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 14/20 0.54
▸ KDR P35968 6/20 0.50
▸ RET P07949 3/20 0.50
▸ KIF5B P33176 2/20 0.47

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
SCHEMBL13404535 0.90 EGFR (0.53) EGFRKDRRETKIF5B
SCHEMBL13404542 0.88 EGFR (0.56) EGFRKDRRETKIF5B
SCHEMBL13404539 0.88 EGFR (0.53) EGFRKDRRET
SCHEMBL13310055 0.84 EGFR (0.64) EGFRKDRRETKIF5B
SCHEMBL16016556 0.84 EGFR (0.64) EGFRKDRRETKIF5B
SCHEMBL13404537 0.83 EGFR (0.47) EGFRKDRRETKIF5B
SCHEMBL13404545 0.78 EGFR (0.54) EGFRKDR
SCHEMBL13310053 0.76 EGFR (0.56) EGFRKDR
SCHEMBL16016555 0.76 EGFR (0.56) EGFRKDR
SCHEMBL13404547 0.75 KDR (0.57) EGFRKDR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100105668-A1 Quinazoline derivatives FREYNE EDDY JEAN EDGARD 2010-04-29 — — US disclosed
US-7648975-B2 Macrocyclic quinazoline derivatives as antiproliferative agents JANSSEN PHARMACEUTICA N.V. (BE) 2010-01-19 — — 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-20100105668-A1 Quinazoline derivatives NR1H2, NR1H3, NR3C2 EGFR 1789/4885KDR 2393/4885RET 1283/4885

“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.

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