SCHEMBL13136243

SCHEMBL13136243

Cc1ccnc(Nc2cccc(-c3cnc(CCc4ccc(NS(C)(=O)=O)cc4)s3)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 11/20 0.46
SYK P43405 3/20 0.45
KDR P35968 1/20 0.39
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36
HIF1A Q16665 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GPR39 O43194 1/20 0.36
JAK2 O60674 1/20 0.36
JAK3 P52333 1/20 0.36

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
SCHEMBL13136241 0.86 NPC1 (0.50) KARS1SYKKDRKDM4EALDH1A1
SCHEMBL2869423 0.85 KARS1 (0.49) KARS1SYKKDRMEN1KMT2A
SCHEMBL13136239 0.85 KARS1 (0.54) KARS1SYKKDRMEN1KMT2A
SCHEMBL2865498 0.85 KARS1 (0.49) KARS1SYKKDRMEN1KMT2A
SCHEMBL2863200 0.84 SYK (0.48) KARS1SYKKDRKDM4EALDH1A1
SCHEMBL13136276 0.84 KARS1 (0.50) KARS1SYKKDRMEN1KMT2A
SCHEMBL2862312 0.84 SYK (0.52) KARS1SYKKDR
SCHEMBL13136173 0.84 KARS1 (0.48) KARS1SYKKDRALDH1A1
SCHEMBL13136183 0.82 SYK (0.49) KARS1SYKKDR
SCHEMBL2857452 0.82 KARS1 (0.52) KARS1SYKKDRMEN1KMT2A

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 3 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
EP-1854793-A1 NOVEL AMINOPYRIDINE COMPOUND WITH Syk INHIBITORY ACTIVITY Japan Tobacco, Inc. (JP) 2007-11-14 EP disclosed