SCHEMBL19100471

SCHEMBL19100471

C#Cc1cccc(Nc2ncnc3cc(OCCOC(F)F)c(NC(=O)/C(=C\C)N(C)C)cc23)c1F

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 19/20 0.48
▸ KDR P35968 8/20 0.48
▸ ERBB2 P04626 4/20 0.45
▸ ABL1 P00519 1/20 0.44
▸ RAF1 P04049 1/20 0.44
▸ LCK P06239 1/20 0.44
▸ RET P07949 1/20 0.44
▸ SRC P12931 1/20 0.44
▸ FGFR2 P21802 1/20 0.44
▸ FLT4 P35916 1/20 0.44
▸ TEK Q02763 1/20 0.44

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
SCHEMBL19100065 0.86 EGFR (0.64) EGFRKDRERBB2
SCHEMBL18013058 0.83 EGFR (0.59) EGFRKDRERBB2ABL1RAF1
SCHEMBL19100472 0.82 EGFR (0.45) EGFRKDRERBB2RET
SCHEMBL19100047 0.77 EGFR (0.58) EGFRKDRERBB2
SCHEMBL20653216 0.77 EGFR (0.58) EGFRKDRERBB2
SCHEMBL19100193 0.76 EGFR (0.68) EGFRKDRERBB2
SCHEMBL19100043 0.76 EGFR (0.49) EGFRKDRERBB2
SCHEMBL19124461 0.75 EGFR (0.63) EGFRKDRERBB2
SCHEMBL19126162 0.75 EGFR (0.49) EGFRKDRERBB2
SCHEMBL20653209 0.75 EGFR (0.48) EGFRKDRERBB2

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
EP-3400216-A1 NOVEL FLUORINATED QUINAZOLINE DERIVATIVES AS EGFR INHIBITORS Trillium Therapeutics Inc. (CA) 2018-11-14 — — EP disclosed
WO-2017117680-A1 NOVEL FLUORINATED QUINAZOLINE DERIVATIVES AS EGFR INHIBITORS TRILLIUM THERAPEUTICS INC. (CA) 2017-07-13 — — WO disclosed
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