SCHEMBL18925890

SCHEMBL18925890

CN[C@H]1CCCCC1Nc1ccc(C(N)=O)c(Nc2cccc3c2ccn3C)n1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 18/20 0.65
▸ FER P16591 1/20 0.51
▸ KCNH2 Q12809 1/20 0.49
▸ JAK2 O60674 1/20 0.49
▸ ROCK2 O75116 1/20 0.49
▸ MAP4K4 O95819 1/20 0.49
▸ HCK P08631 1/20 0.49
▸ ROS1 P08922 1/20 0.49
▸ PIM1 P11309 1/20 0.49
▸ PRKACA P17612 1/20 0.49
▸ MARK3 P27448 1/20 0.49
▸ LTK P29376 1/20 0.49
▸ FLT3 P36888 1/20 0.49
▸ CSNK1A1 P48729 1/20 0.49
▸ CLK2 P49760 1/20 0.49
▸ MAPK10 P53779 1/20 0.49
▸ MAP2K1 Q02750 1/20 0.49
▸ MAP3K10 Q02779 1/20 0.49
▸ PRKCQ Q04759 1/20 0.49
▸ PTK2 Q05397 1/20 0.49

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
SCHEMBL2715267 0.92 SYK (0.77) SYKFERKCNH2JAK2ROCK2
SCHEMBL18925375 0.86 SYK (0.61) SYK
SCHEMBL20750870 0.86 SYK (0.61) SYK
SCHEMBL5028187 0.85 SYK (0.59) SYKFERKCNH2
SCHEMBL18925495 0.81 SYK (0.63) SYKFERKCNH2JAK2ROCK2
SCHEMBL2713206 0.79 SYK (0.69) SYKFERKCNH2JAK2ROCK2
SCHEMBL16194783 0.79 SYK (0.84) SYK
SCHEMBL1353821 0.79 SYK (1.00) SYK
SCHEMBL18925887 0.79 SYK (0.54) SYKFERKCNH2JAK2ROCK2
SCHEMBL9109091 0.78 SYK (0.72) SYK

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
EP-3176154-A1 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS Portola Pharmaceuticals, Inc. (US) 2017-06-07 — — EP disclosed
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