SCHEMBL18926180

SCHEMBL18926180

N=C/C=N\Nc1cccc(Nc2nc(N[C@@H]3CCCC(F)(F)[C@@H]3N)ccc2C(N)=O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 9/20 0.54
▸ FER P16591 4/20 0.52
▸ JAK2 O60674 2/20 0.52
▸ ROCK2 O75116 2/20 0.52
▸ MAP4K4 O95819 2/20 0.52
▸ HCK P08631 2/20 0.52
▸ ROS1 P08922 2/20 0.52
▸ PIM1 P11309 2/20 0.52
▸ PRKACA P17612 2/20 0.52
▸ MARK3 P27448 2/20 0.52
▸ LTK P29376 2/20 0.52
▸ CSNK1A1 P48729 2/20 0.52
▸ CLK2 P49760 2/20 0.52
▸ MAPK10 P53779 2/20 0.52
▸ MAP2K1 Q02750 2/20 0.52
▸ MAP3K10 Q02779 2/20 0.52
▸ PRKCQ Q04759 2/20 0.52
▸ PTK2 Q05397 2/20 0.52
▸ TYRO3 Q06418 2/20 0.52
▸ STK3 Q13188 2/20 0.52

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
SCHEMBL18926189 0.90 SYK (0.52) SYKFERJAK2ROCK2MAP4K4
SCHEMBL18926198 0.89 SYK (0.50) SYKFERJAK2ROCK2MAP4K4
SCHEMBL18925817 0.88 SYK (0.54) SYKFERJAK2ROCK2MAP4K4
SCHEMBL18925297 0.87 SYK (0.69) SYKFERJAK2ROCK2MAP4K4
SCHEMBL18925296 0.85 SYK (0.59) SYKFERJAK2ROCK2MAP4K4
SCHEMBL18925769 0.81 SYK (0.53) SYKFERJAK2ROCK2MAP4K4
SCHEMBL5027968 0.81 SYK (0.59) SYKFERJAK2ROCK2MAP4K4
SCHEMBL5028025 0.80 SYK (0.76) SYKFERJAK2ROCK2MAP4K4
SCHEMBL5028169 0.79 SYK (0.57) SYKFERJAK2ROCK2MAP4K4
SCHEMBL18925871 0.79 SYK (0.43) SYKFERJAK2ROCK2MAP4K4

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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