SCHEMBL2945452

SCHEMBL2945452

COCCN1CCc2ccc(Nc3ncc(Cl)c(Nc4ccccc4C(=O)NCCCCN(C)C)n3)cc2CC1.COCCN1CCc2ccc(Nc3ncc(Cl)c(Nc4ccccc4C(=O)NCCCCN(C)C)n3)cc2CC1

nearest known ligand 0.77

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MET P08581 11/20 0.77
INSR P06213 8/20 0.77
ALK Q9UM73 12/20 0.55
EGFR P00533 2/20 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
SCHEMBL886613 1.00 MET (0.77) METINSRALKEGFR
SCHEMBL886031 0.98 MET (0.78) METINSRALKEGFR
SCHEMBL886538 0.95 MET (0.80) METINSRALKEGFR
SCHEMBL2942944 0.95 MET (0.80) METINSRALKEGFR
SCHEMBL2940464 0.93 MET (0.83) METINSRALKEGFR
SCHEMBL886364 0.93 MET (0.83) METINSRALKEGFR
SCHEMBL2945450 0.93 MET (0.67) METINSRALKEGFR
SCHEMBL885893 0.92 MET (0.81) METINSRALKEGFR
SCHEMBL886137 0.92 MET (0.86) METINSRALKEGFR
SCHEMBL886299 0.90 MET (0.83) METINSRALKEGFR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2222647-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS Cephalon, Inc. (US) 2010-09-01 EP disclosed
WO-2008051547-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS CEPHALON, INC. (US) 2008-05-02 WO disclosed