SCHEMBL13136647

SCHEMBL13136647

Cc1ccnc(Nc2cccc(-c3ccc(C(=O)NC4CC4)s3)n2)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.51
KARS1 Q15046 11/20 0.49
MAPK11 Q15759 3/20 0.48
MAPK14 Q16539 3/20 0.48
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
KDM4E B2RXH2 1/20 0.47
TP53 P04637 1/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MAPK13 O15264 1/20 0.43
MAPK12 P53778 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
DYRK1A Q13627 1/20 0.42
DYRK1B Q9Y463 1/20 0.42

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
SCHEMBL2856828 0.86 KARS1 (0.54) SYKKARS1NPC1RAB9AKDM4E
SCHEMBL13136552 0.84 KARS1 (0.56) SYKKARS1NPC1RAB9AKDM4E
SCHEMBL2864883 0.84 KARS1 (0.56) SYKKARS1NPC1RAB9AKDM4E
SCHEMBL13136555 0.84 KARS1 (0.58) SYKKARS1NPC1RAB9AMEN1
SCHEMBL13136588 0.84 KARS1 (0.51) SYKKARS1NPC1RAB9ASMN1; SMN2
SCHEMBL2871084 0.83 AKT3 (0.58) SYKKARS1NPC1RAB9AMEN1
SCHEMBL2869562 0.83 KARS1 (0.55) SYKKARS1NPC1RAB9AKDM4E
SCHEMBL13136629 0.82 KARS1 (0.48) SYKKARS1NPC1RAB9AMEN1
SCHEMBL13136551 0.82 KARS1 (0.54) SYKKARS1NPC1RAB9AKDM4E
SCHEMBL13136634 0.82 KARS1 (0.49) 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