SCHEMBL2715434

SCHEMBL2715434

COCCOc1cccc(Nc2nc(N(N)C(C)CC=O)[nH]c(=O)c2C(N)=O)c1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 10/20 0.40
EGFR P00533 6/20 0.40
BTK Q06187 4/20 0.36
JAK2 O60674 1/20 0.35
LYN P07948 1/20 0.35
TEC P42680 1/20 0.35
TXK P42681 1/20 0.35
BMX P51813 1/20 0.35
JAK3 P52333 1/20 0.35
CD69 Q07108 1/20 0.35
ITK Q08881 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.35
FBP1 P09467 1/20 0.35

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
SCHEMBL2715431 1.00 SYK (0.40) SYKEGFRBTKJAK2LYN
SCHEMBL2718804 0.90 SYK (0.42) SYKEGFRBTKJAK2LYN
SCHEMBL2715377 0.90 SYK (0.42) SYKEGFRBTKJAK2LYN
SCHEMBL2715849 0.88 PIK3CA (0.38) SYK
SCHEMBL2716094 0.86 EGFR (0.38) SYKEGFRITK
SCHEMBL2718568 0.85 SYK (0.41) SYK
SCHEMBL2715948 0.83 SYK (0.46) SYKBTK
SCHEMBL2715944 0.83 SYK (0.46) SYKBTK
SCHEMBL2719062 0.82 GAA (0.44) SYKJAK2
SCHEMBL2717572 0.81 EGFR (0.38) SYKEGFRITK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012061415-A1 OXYPYRIMIDINES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 WO disclosed