SCHEMBL17538501

SCHEMBL17538501

CNC/C=C/C(=O)Nc1cc2c(Nc3ccc(OCCOCC(F)(F)F)c(Cl)c3)ncnc2cc1OCCOC

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 20/20 0.66
▸ ERBB2 P04626 9/20 0.62

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
SCHEMBL17538500 0.92 EGFR (0.69) EGFRERBB2
SCHEMBL17538482 0.85 EGFR (0.81) EGFRERBB2
SCHEMBL17538486 0.84 EGFR (0.85) EGFRERBB2
SCHEMBL17538476 0.83 EGFR (0.81) EGFRERBB2
SCHEMBL17538504 0.82 EGFR (0.83) EGFRERBB2
SCHEMBL17498519 0.81 EGFR (0.83) EGFRERBB2
SCHEMBL16405547 0.81 EGFR (0.83) EGFRERBB2
SCHEMBL20325513 0.81 EGFR (0.84) EGFRERBB2
SCHEMBL17538507 0.79 EGFR (0.87) EGFRERBB2
SCHEMBL19027000 0.78 EGFR (0.58) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016023217-A1 QUINAZOLINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF 安润医药科技(苏州)有限公司 2016-02-18 — — WO disclosed
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