SCHEMBL13136175

SCHEMBL13136175

CC(=O)N[C@@H](Cc1ccc(OCCO)cc1)c1ncc(-c2cccc(Nc3cc(C)ccn3)n2)s1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 8/20 0.44
SYK P43405 2/20 0.43
KDR P35968 1/20 0.38
MEN1 O00255 2/20 0.38
NPC1 O15118 2/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MAPK1 P28482 1/20 0.38
ITGB3 P05106 2/20 0.37
ITGB1 P05556 2/20 0.37
ITGAV P06756 2/20 0.37
ITGA5 P08648 2/20 0.37
PTPRB P23467 2/20 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
SCHEMBL13136172 0.91 SYK (0.44) KARS1SYKMEN1NPC1MAPT
SCHEMBL13136095 0.90 SYK (0.44) KARS1SYK
SCHEMBL13136123 0.89 SYK (0.46) KARS1SYKKDRMEN1NPC1
SCHEMBL13136039 0.89 SYK (0.49) KARS1SYKKDRMEN1NPC1
SCHEMBL13136211 0.87 NPC1 (0.49) KARS1SYKKDRMEN1NPC1
SCHEMBL13136176 0.85 SYK (0.43) KARS1SYKKDRMEN1NPC1
SCHEMBL13136056 0.85 SYK (0.49) KARS1SYKKDRMEN1NPC1
SCHEMBL13136213 0.82 SYK (0.41) KARS1SYKKDRMEN1NPC1
SCHEMBL13136042 0.81 SYK (0.46) KARS1SYKKDRMEN1NPC1
SCHEMBL13136092 0.81 PTPRB (0.50) KARS1SYKKMT2AALDH1A1LMNA

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