SCHEMBL13136333

SCHEMBL13136333

Cc1ccnc(Nc2cccc(-c3cnc([C@H](C)NC(=O)c4ccc(O)cc4)s3)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 4/20 0.47
KARS1 Q15046 9/20 0.47
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KDR P35968 1/20 0.39
POLB P06746 1/20 0.39
KCNN1 Q92952 1/20 0.38
KCNN2 Q9H2S1 1/20 0.38
KCNN3 Q9UGI6 1/20 0.38
SLC2A1 P11166 1/20 0.38
JAK2 O60674 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
SCHEMBL13136335 0.93 SYK (0.51) SYKKARS1NPC1RAB9AMEN1
SCHEMBL13136380 0.89 SYK (0.46) SYKKARS1NPC1RAB9AMEN1
SCHEMBL13136339 0.87 SYK (0.46) SYKKARS1NPC1RAB9AMEN1
SCHEMBL2859100 0.87 KARS1 (0.52) SYKKARS1NPC1RAB9AMEN1
SCHEMBL13136024 0.86 KARS1 (0.51) SYKKARS1NPC1RAB9AMEN1
SCHEMBL13136025 0.85 KARS1 (0.50) SYKKARS1NPC1RAB9AMEN1
SCHEMBL13136054 0.85 KARS1 (0.50) SYKKARS1NPC1RAB9AMEN1
SCHEMBL13136053 0.84 SYK (0.49) SYKKARS1NPC1RAB9AMEN1
SCHEMBL2872543 0.84 KARS1 (0.50) SYKKARS1NPC1RAB9AMEN1
SCHEMBL13136159 0.84 SYK (0.51) SYKKARS1NPC1RAB9AMEN1

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