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SCHEMBL3264899

SCHEMBL3264899

CNC(=O)c1cc(-c2cnn(C)c2)cc(F)c1Nc1nc([AsH]c2ccc3c(c2)CCN(CCOC)CC3)ncc1Cl

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ INSR P06213 12/20 0.58
▸ MET P08581 9/20 0.58
▸ ALK Q9UM73 9/20 0.41
▸ MAP4K1 Q92918 1/20 0.38
▸ WNT1 P04628 1/20 0.37
▸ GSK3B P49841 1/20 0.37
▸ DYRK1A Q13627 1/20 0.37

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
SCHEMBL2938646 0.87 INSR (0.77) INSRMETALK
SCHEMBL886685 0.87 INSR (0.77) INSRMETALK
SCHEMBL3264905 0.87 INSR (0.46) INSRMETALKWNT1GSK3B
SCHEMBL3264908 0.83 INSR (0.47) INSRMETALKWNT1GSK3B
SCHEMBL885837 0.77 INSR (0.84) INSRMETALK
SCHEMBL2061318 0.76 MET (0.44) INSRMET
SCHEMBL886503 0.75 INSR (0.82) INSRMETALK
SCHEMBL3005454 0.74 MET (0.61) INSRMETALKMAP4K1
SCHEMBL886140 0.74 MET (1.00) INSRMETALK
SCHEMBL3006529 0.72 MET (0.60) INSRMETALKMAP4K1

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