SCHEMBL24327482

SCHEMBL24327482

CNCCNC1CCN(c2ccc(Nc3ncc(Cl)c(Nc4cccc5c4N(C(=O)NC)CC5)n3)c(OC)c2)CC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 8/20 0.62
▸ ALK Q9UM73 10/20 0.55
▸ ZAP70 P43403 2/20 0.55
▸ INSR P06213 6/20 0.55
▸ IGF1R P08069 6/20 0.55
▸ CDC7 O00311 1/20 0.55
▸ PLK4 O00444 1/20 0.55
▸ CHEK1 O14757 1/20 0.55
▸ AURKA O14965 1/20 0.55
▸ DCLK1 O15075 1/20 0.55
▸ PDPK1 O15530 1/20 0.55
▸ DAPK3 O43293 1/20 0.55
▸ DYRK3 O43781 1/20 0.55
▸ JAK2 O60674 1/20 0.55
▸ PRKD3 O94806 1/20 0.55
▸ PAK4 O96013 1/20 0.55
▸ CHEK2 O96017 1/20 0.55
▸ ERBB2 P04626 1/20 0.55
▸ PRKCG P05129 1/20 0.55
▸ LCK P06239 1/20 0.55

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
SCHEMBL24326983 0.94 EGFR (0.63) EGFRALKZAP70INSRIGF1R
SCHEMBL24327012 0.92 EGFR (0.61) EGFRALKZAP70INSRIGF1R
SCHEMBL24326970 0.87 ALK (0.72) EGFRALKZAP70INSRIGF1R
SCHEMBL24328341 0.87 EGFR (0.67) EGFRALKZAP70INSRIGF1R
SCHEMBL24327472 0.86 EGFR (0.64) EGFRALKZAP70INSRIGF1R
SCHEMBL24327331 0.85 EGFR (0.62) EGFRALKZAP70INSRIGF1R
SCHEMBL24327355 0.85 EGFR (0.62) EGFRALKZAP70INSRIGF1R
SCHEMBL24328348 0.85 EGFR (0.65) EGFRALKZAP70INSRIGF1R
SCHEMBL24327578 0.85 EGFR (0.62) EGFRALKZAP70INSRIGF1R
SCHEMBL24327466 0.85 EGFR (0.65) EGFRALKZAP70INSRIGF1R

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-2022063106-A1 INDOLINE COMPOUNDS AND DERIVATIVES AS EGFR INHIBITORS BEIGENE, LTD. (KY) 2022-03-31 — — WO disclosed
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