SCHEMBL2991915

SCHEMBL2991915

COC(CN1CCc2ccc([AsH]c3ncc(Cl)c(NCc4ccccc4C(N)=O)n3)cc2CC1)C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
INSR P06213 6/20 0.37
MET P08581 4/20 0.37
STAT6 P42226 3/20 0.34
MAP4K1 Q92918 6/20 0.34
ALK Q9UM73 4/20 0.34
MAPK8 P45983 1/20 0.33
JAK2 O60674 2/20 0.32
JAK1 P23458 2/20 0.32
JAK3 P52333 2/20 0.32
TYK2 P29597 1/20 0.32

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
SCHEMBL3006532 0.87 INSR (0.40) INSRMETSTAT6ALKJAK2
SCHEMBL2991920 0.85 MET (0.49) INSRMETMAP4K1ALKJAK2
SCHEMBL2991913 0.82 MET (0.57) INSRMETMAP4K1ALKMAPK8
SCHEMBL2991917 0.82 MET (0.57) INSRMETMAP4K1ALKMAPK8
SCHEMBL3007400 0.72 INSR (0.58) INSRMETSTAT6ALKMAPK8
SCHEMBL3006537 0.71 MET (0.51) INSRMETMAP4K1ALKJAK2
SCHEMBL886121 0.70 MET (0.75) INSRMETMAP4K1ALK
SCHEMBL886120 0.70 MET (0.75) INSRMETMAP4K1ALK
SCHEMBL3006529 0.68 MET (0.60) INSRMETMAP4K1ALKMAPK8
SCHEMBL3005454 0.67 MET (0.61) INSRMETMAP4K1ALK

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