SCHEMBL22595445

SCHEMBL22595445

CCc1cc(Nc2ncc(Br)c(Nc3ccc4nccnc4c3P(C)(C)=O)n2)c(OC)cc1N1CCCN(C2CCN(C)CC2)CC1

nearest known ligand 0.93

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 20/20 0.93

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
SCHEMBL22595663 0.96 EGFR (1.00) EGFR
SCHEMBL22025903 0.95 EGFR (1.00) EGFR
SCHEMBL22821788 0.94 EGFR (0.95) EGFR
SCHEMBL26053608 0.91 EGFR (0.90) EGFR
SCHEMBL22821707 0.91 EGFR (0.89) EGFR
SCHEMBL22595547 0.90 EGFR (0.84) EGFR
SCHEMBL22821921 0.90 EGFR (0.88) EGFR
SCHEMBL25340594 0.90 EGFR (0.88) EGFR
SCHEMBL22821816 0.90 EGFR (0.88) EGFR
SCHEMBL30579737 0.90 EGFR (0.88) 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-2020216371-A1 EGFR INHIBITOR AND APPLICATION THEREOF 江苏先声药业有限公司 2020-10-29 — — WO disclosed
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