SCHEMBL13136165

SCHEMBL13136165

CC(=O)NCCCCCc1ncc(-c2cccc(Nc3cc(C)ccn3)n2)s1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SYK P43405 8/20 0.51
KARS1 Q15046 9/20 0.47
KDR P35968 1/20 0.39
MEN1 O00255 2/20 0.39
NPC1 O15118 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAPK1 P28482 1/20 0.38

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
SCHEMBL13136271 0.93 SYK (0.54) SYKKARS1KDRMEN1NPC1
SCHEMBL13136164 0.88 SYK (0.51) SYKKARS1MAPT
SCHEMBL2869810 0.87 KARS1 (0.53) SYKKARS1KDRMEN1NPC1
SCHEMBL13136179 0.87 SYK (0.53) SYKKARS1KDRMEN1NPC1
SCHEMBL2865358 0.86 SYK (0.53) SYKKARS1KDRNPC1SMN1; SMN2
SCHEMBL2866523 0.86 SYK (0.51) SYKKARS1KDR
SCHEMBL2868941 0.86 KARS1 (0.53) SYKKARS1KDRMEN1NPC1
SCHEMBL13136168 0.85 SYK (0.54) SYKKARS1KDRNPC1SMN1; SMN2
SCHEMBL2868020 0.85 KARS1 (0.56) SYKKARS1KDR
SCHEMBL13136069 0.85 SYK (0.50) SYKKARS1KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7803801-B2 Aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO, INC. (JP) 2010-09-28 US disclosed
US-7803801-B2 Aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO, INC. (JP) 2010-09-28 US disclosed