SCHEMBL12616048

SCHEMBL12616048

Nc1ccc2ncc(-c3nccc(NC4CCCCC4)n3)n2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 1/20 0.44
▸ IRAK4 Q9NWZ3 11/20 0.43
▸ CTSK P43235 1/20 0.43
▸ FLT3 P36888 5/20 0.42
▸ IRAK1 P51617 4/20 0.42
▸ LCK P06239 2/20 0.42
▸ RET P07949 2/20 0.42
▸ PDGFRB P09619 2/20 0.42
▸ CDK7 P50613 2/20 0.42
▸ BLK P51451 2/20 0.42
▸ CCNH P51946 2/20 0.42
▸ SRPK1 Q96SB4 1/20 0.42
▸ EIF2AK4 Q9P2K8 3/20 0.40
▸ FYN P06241 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39

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
SCHEMBL12615082 0.89 FYN (0.53) MKNK1IRAK4FLT3IRAK1LCK
SCHEMBL12611013 0.89 MAPK8 (0.48) MKNK1IRAK4FLT3IRAK1LCK
SCHEMBL1997583 0.84 IRAK4 (0.60) MKNK1IRAK4CTSKFLT3IRAK1
SCHEMBL12643896 0.84 KIT (0.42) IRAK4EIF2AK4
SCHEMBL12616146 0.84 EIF2AK4 (0.49) EIF2AK4
SCHEMBL12611153 0.82 EIF2AK4 (0.43) IRAK4EIF2AK4
SCHEMBL12643881 0.81 EIF2AK4 (0.43) FLT3EIF2AK4
SCHEMBL12614361 0.81 EIF2AK4 (0.43) IRAK4FLT3EIF2AK4
SCHEMBL12614083 0.81 EIF2AK4 (0.46) IRAK4FLT3EIF2AK4
SCHEMBL12615626 0.81 JAK2 (0.42) EIF2AK4

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-2338888-A1 Imidazopyridine derivatives as JAK inhibitors Almirall, S.A. (ES) 2011-06-29 — — EP disclosed
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