SCHEMBL6666471

SCHEMBL6666471

Nc1ccc2ncnc(Nc3ccc(NC=O)cc3)c2c1

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EGFR P00533 19/20 0.68
ERBB2 P04626 3/20 0.56
KIT P10721 1/20 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
SCHEMBL2103341 0.87 EGFR (0.82) EGFRERBB2
SCHEMBL6668474 0.85 HTT (0.68) EGFRERBB2
SCHEMBL4586685 0.82 EGFR (0.75) EGFRERBB2
SCHEMBL27685863 0.81 EGFR (0.73) EGFRERBB2
SCHEMBL27923391 0.81 EGFR (0.73) EGFRERBB2
SCHEMBL29690398 0.81 EGFR (1.00) EGFRERBB2
SCHEMBL30513 0.81 EGFR (1.00) EGFRERBB2
SCHEMBL6663823 0.81 ALK (0.74) EGFRKIT
SCHEMBL6664062 0.77 EGFR (0.72) EGFR
SCHEMBL2987637 0.76 EGFR (0.73) EGFRERBB2

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
WO-2004013091-A2 4-ANILIDO SUBSTITUTED QUINAZOLINES AND USE THEREOF AS INHIBITORS OF EPIDERMAL GROWTH FACTOR RECEPTOR KINASES YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 2004-02-12 WO claimed
WO-2004013091-A2 4-ANILIDO SUBSTITUTED QUINAZOLINES AND USE THEREOF AS INHIBITORS OF EPIDERMAL GROWTH FACTOR RECEPTOR KINASES YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 2004-02-12 WO disclosed