SCHEMBL21761329

SCHEMBL21761329

C=Nc1cc(OCC2CC2)c(NC(=O)/C=C/CBr)cc1/C(=N\C)Nc1ccc(F)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 20/20 0.47
▸ ERBB2 P04626 13/20 0.47
▸ ERBB4 Q15303 1/20 0.39

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
SCHEMBL19779461 0.79 EGFR (0.59) EGFRERBB2ERBB4
SCHEMBL18633118 0.78 EGFR (0.53) EGFRERBB2ERBB4
SCHEMBL18595973 0.77 EGFR (0.50) EGFRERBB2ERBB4
SCHEMBL21965724 0.77 EGFR (0.63) EGFRERBB2ERBB4
SCHEMBL18427554 0.77 EGFR (0.63) EGFRERBB2ERBB4
SCHEMBL18633119 0.77 EGFR (0.53) EGFRERBB2ERBB4
SCHEMBL18595837 0.76 EGFR (0.51) EGFRERBB2ERBB4
SCHEMBL18427475 0.76 EGFR (0.49) EGFRERBB2ERBB4
SCHEMBL18873071 0.75 EGFR (0.48) EGFRERBB2ERBB4
SCHEMBL21761308 0.75 EGFR (0.40) 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
EP-3022186-B1 QUINAZOLINE DERIVATIVES, COMPOSITIONS THEREOF, AND USE AS PHARMACEUTICALS SHANGHAI FOCHON PHARMACEUTICAL CO LTD (CN) 2020-02-26 — — EP disclosed
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