SCHEMBL5569239

SCHEMBL5569239

COc1cc2ncnc(Nc3ccc(OCc4cnccn4)c(Cl)c3)c2cc1OC1CCNCC1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHA2 P29317 14/20 0.61
KDR P35968 14/20 0.61
EPHB4 P54760 12/20 0.61
EGFR P00533 6/20 0.59
ERBB2 P04626 9/20 0.55
FLT1 P17948 3/20 0.55
GAK O14976 1/20 0.52

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
SCHEMBL30638095 1.00 EPHA2 (0.61) EPHA2KDREPHB4EGFRERBB2
SCHEMBL29087923 0.92 EPHA2 (0.56) EPHA2KDREPHB4EGFRERBB2
SCHEMBL30638106 0.92 EPHA2 (0.56) EPHA2KDREPHB4EGFRERBB2
SCHEMBL5568278 0.91 EGFR (0.69) EPHA2KDREPHB4EGFRERBB2
SCHEMBL30638107 0.91 EGFR (0.69) EPHA2KDREPHB4EGFRERBB2
SCHEMBL5568035 0.87 EGFR (0.58) EPHA2KDREPHB4EGFRERBB2
SCHEMBL5564700 0.87 EGFR (0.69) EPHA2KDREPHB4EGFRERBB2
SCHEMBL5569617 0.86 EGFR (0.67) EPHA2KDREPHB4EGFRERBB2
SCHEMBL5565280 0.84 EGFR (0.66) EPHA2KDREPHB4EGFRERBB2
SCHEMBL30638099 0.84 EGFR (0.64) EPHA2KDREPHB4EGFRERBB2

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
CN-116655599-A Synthesis and application of EGFR allosteric inhibitors 江南大学 2023-08-29 CN disclosed
US-20070032508-A1 Quinazoline derivatives as tyrosine kinase inhibitors ASTRAZENECA AB (SE) 2007-02-08 US disclosed
EP-1664028-A1 QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS AstraZeneca AB (SE) 2006-06-07 EP disclosed
WO-2005026151-A1 QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2005-03-24 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-20070032508-A1 Quinazoline derivatives as tyrosine kinase inhibitors ABL1, ERBB2, LCK EPHA2 699/4885KDR 49/4885EPHB4 1447/4885

“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.