SCHEMBL22942135

SCHEMBL22942135

CCc1cc(Nc2ncc(Br)c(Nc3ccc(C)c(C)c3P(C)(C)=O)n2)c(OC)cc1N1CCC(N2CCCCC2)CC1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 20/20 0.72

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
SCHEMBL22942142 0.94 EGFR (0.80) EGFR
SCHEMBL22942151 0.93 EGFR (0.77) EGFR
SCHEMBL22942870 0.92 EGFR (0.66) EGFR
SCHEMBL29559850 0.92 EGFR (0.66) EGFR
SCHEMBL22942225 0.91 EGFR (0.67) EGFR
SCHEMBL24780479 0.90 EGFR (0.81) EGFR
SCHEMBL29558563 0.88 EGFR (0.61) EGFR
SCHEMBL22950986 0.88 EGFR (0.61) EGFR
SCHEMBL22942330 0.88 EGFR (0.67) EGFR
SCHEMBL22951318 0.88 EGFR (0.58) EGFR

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-2021018003-A1 EGFR INHIBITOR, COMPOSITION, AND PREPARATION METHOD THEREFOR 贝达药业股份有限公司 2021-02-04 — — WO disclosed
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