SCHEMBL24992306

SCHEMBL24992306

CCc1cc(Nc2ncc(Cl)c(Nc3ccc4c(c3N(C)S(C)(=O)=O)OCCO4)n2)c(OC)cc1N1CCN(C)CC1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 12/20 0.54
▸ MET P08581 1/20 0.52
▸ ALK Q9UM73 8/20 0.49
▸ BRD4 O60885 1/20 0.47
▸ INSR P06213 3/20 0.46
▸ IGF1R P08069 3/20 0.46

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
SCHEMBL24993148 0.94 EGFR (0.61) EGFRMETALKINSRIGF1R
SCHEMBL24993179 0.94 EGFR (0.55) EGFRMET
SCHEMBL24993676 0.93 EGFR (0.54) EGFRMETBRD4
SCHEMBL24993180 0.91 EGFR (0.53) EGFRMET
SCHEMBL24993075 0.91 EGFR (0.53) EGFRMET
SCHEMBL24993675 0.90 EGFR (0.53) EGFRALK
SCHEMBL27075983 0.90 EGFR (0.58) EGFRMETALKINSRIGF1R
SCHEMBL30015267 0.90 EGFR (0.58) EGFRMETALKINSRIGF1R
SCHEMBL24992297 0.90 EGFR (0.57) EGFRMETALKINSRIGF1R
SCHEMBL24993673 0.88 EGFR (0.48) EGFRALK

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-2023011610-A1 BENZODIOXANE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 南京红云生物科技有限公司 2023-02-09 — — WO disclosed
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