SCHEMBL13136113

SCHEMBL13136113

Cc1ccnc(Nc2cccc(-c3cnc([C@H](CCC(=O)OCc4ccccc4)NC(=O)OC(C)(C)C)s3)n2)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPRB P23467 2/20 0.42
SYK P43405 6/20 0.42
KARS1 Q15046 5/20 0.39
PTPN1 P18031 4/20 0.38
MAPT P10636 1/20 0.38
KDR P35968 1/20 0.36
JAK2 O60674 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
PKM P14618 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL13136120 0.91 SYK (0.44) SYKKARS1MAPTKDRJAK2
SCHEMBL13136040 0.90 PTPRB (0.44) PTPRBSYKKARS1KDRJAK2
SCHEMBL13136034 0.89 PTPRB (0.53) PTPRBSYKKARS1PTPN1KDR
SCHEMBL13136044 0.88 MAPT (0.48) PTPRBSYKMAPTKMT2ANPSR1
SCHEMBL13136092 0.86 PTPRB (0.50) PTPRBSYKKARS1PTPN1JAK2
SCHEMBL13136115 0.86 SYK (0.45) SYKKARS1KDRJAK2
SCHEMBL13135987 0.81 SYK (0.47) SYKKARS1KDR
SCHEMBL13136028 0.81 SYK (0.47) SYKKARS1KDR
SCHEMBL13136042 0.80 SYK (0.46) SYKKARS1MAPTKDRJAK2
SCHEMBL13136132 0.79 SYK (0.49) SYKKARS1MAPTKDRJAK2

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