SCHEMBL24940905

SCHEMBL24940905

CCc1cc(Nc2ncc(Cl)c(Nc3ccc(C)c(C)c3P(C)(C)=O)n2)c(OC)cc1N1CC2(CCN(CC(F)F)CC2)C1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 13/20 0.57
▸ ALK Q9UM73 8/20 0.52

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
SCHEMBL30105883 0.92 EGFR (0.65) EGFRALK
SCHEMBL24940072 0.92 EGFR (0.65) EGFRALK
SCHEMBL24940743 0.90 EGFR (0.58) EGFRALK
SCHEMBL24940906 0.90 ALK (0.57) EGFRALK
SCHEMBL24940070 0.89 EGFR (0.61) EGFRALK
SCHEMBL24940741 0.88 ALK (0.55) EGFRALK
SCHEMBL24940075 0.88 EGFR (0.63) EGFRALK
SCHEMBL24940722 0.88 EGFR (0.62) EGFRALK
SCHEMBL24940721 0.88 EGFR (0.67) EGFRALK
SCHEMBL24940745 0.87 EGFR (0.62) 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-2023006088-A1 COMPOUND FOR EGFR KINASE INHIBITOR, COMPOSITION AND USE THEREOF 浙江大学智能创新药物研究院 2023-02-02 — — WO disclosed
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