SCHEMBL3009983

SCHEMBL3009983

CCCNC(=O)c1ccccc1[AsH]c1nc(Nc2ccc3c(c2)C(C)(C)CCC(=O)N3)ncc1Cl

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MET P08581 17/20 0.61
INSR P06213 13/20 0.61
MAP4K3 Q8IVH8 1/20 0.40
MAP4K1 Q92918 1/20 0.40
IRAK4 Q9NWZ3 1/20 0.40
ULK1 O75385 1/20 0.40
PTK2 Q05397 1/20 0.39
ALK Q9UM73 2/20 0.36

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
SCHEMBL3008387 0.90 MET (0.74) METINSRULK1ALK
SCHEMBL886640 0.86 MET (0.82) METINSRULK1ALK
SCHEMBL2939477 0.84 MET (0.77) METINSRULK1ALK
SCHEMBL886145 0.82 MET (0.80) METINSRULK1ALK
SCHEMBL3008399 0.79 MET (0.65) METINSRPTK2
SCHEMBL3008394 0.79 MET (0.61) METINSRPTK2
SCHEMBL3009987 0.77 MET (0.58) METINSRPTK2
SCHEMBL3005088 0.76 MET (0.51) METINSRULK1PTK2
SCHEMBL886710 0.76 MET (1.00) METINSRULK1PTK2ALK
SCHEMBL2061757 0.76 MET (0.85) METINSR

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