SCHEMBL5026602

SCHEMBL5026602

NC(=O)c1ccc(N[C@@H]2CCCCC[C@@H]2N)nc1Nc1ccc2ccncc2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 18/20 0.65
▸ JAK2 O60674 1/20 0.65
▸ ROCK2 O75116 1/20 0.65
▸ MAP4K4 O95819 1/20 0.65
▸ HCK P08631 1/20 0.65
▸ ROS1 P08922 1/20 0.65
▸ PIM1 P11309 1/20 0.65
▸ PRKACA P17612 1/20 0.65
▸ MARK3 P27448 1/20 0.65
▸ LTK P29376 1/20 0.65
▸ FLT3 P36888 1/20 0.65
▸ CSNK1A1 P48729 1/20 0.65
▸ CLK2 P49760 1/20 0.65
▸ MAPK10 P53779 1/20 0.65
▸ MAP2K1 Q02750 1/20 0.65
▸ MAP3K10 Q02779 1/20 0.65
▸ PRKCQ Q04759 1/20 0.65
▸ PTK2 Q05397 1/20 0.65
▸ TYRO3 Q06418 1/20 0.65
▸ STK3 Q13188 1/20 0.65

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
SCHEMBL9108748 0.99 SYK (0.66) SYKJAK2ROCK2MAP4K4HCK
SCHEMBL5026463 0.96 SYK (0.65) SYKJAK2ROCK2MAP4K4HCK
SCHEMBL9107462 0.95 SYK (0.66) SYKJAK2ROCK2MAP4K4HCK
SCHEMBL18926135 0.90 SYK (0.56) SYKJAK2ROCK2MAP4K4HCK
SCHEMBL9108311 0.86 SYK (0.61) SYKJAK2ROCK2MAP4K4HCK
SCHEMBL18926122 0.86 SYK (0.56) SYKJAK2ROCK2MAP4K4HCK
SCHEMBL5028128 0.85 SYK (0.70) SYKJAK2ROCK2MAP4K4HCK
SCHEMBL14981554 0.85 SYK (0.77) SYKKCNH2
SCHEMBL14911371 0.84 SYK (0.59) SYKFER
SCHEMBL14929486 0.84 SYK (0.59) SYKFER

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-2012061418-A2 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 — — WO disclosed
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