SCHEMBL3015153

SCHEMBL3015153

CNC(=O)N1CCc2cc(OC)c([As](C)c3ncc(Cl)c(Nc4cc(C(N)=O)ccc4OC)n3)cc2CC1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 15/20 0.50
INSR P06213 3/20 0.50
MAP4K1 Q92918 3/20 0.45
MET P08581 2/20 0.44
LRRK2 Q5S007 1/20 0.44
ZAP70 P43403 1/20 0.40

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
SCHEMBL886687 0.83 ALK (0.53) ALKINSRMAP4K1METLRRK2
SCHEMBL886686 0.75 ALK (0.75) ALKINSRMAP4K1METLRRK2
SCHEMBL886362 0.74 ALK (0.69) ALKINSRMAP4K1METLRRK2
SCHEMBL2062725 0.73 LRRK2 (0.59) ALKINSRLRRK2
SCHEMBL3015152 0.73 ALK (0.57) ALKINSRMAP4K1METLRRK2
SCHEMBL886756 0.72 ALK (0.71) ALKINSRMAP4K1METLRRK2
SCHEMBL886668 0.72 ALK (0.69) ALKINSRMAP4K1MET
SCHEMBL886638 0.71 ALK (0.91) ALKINSRMAP4K1METLRRK2
SCHEMBL886482 0.68 MAP4K1 (0.59) ALKINSRMAP4K1METLRRK2
SCHEMBL885933 0.68 ALK (0.78) ALKINSRMAP4K1METLRRK2

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