SCHEMBL13136161

SCHEMBL13136161

Cc1ccnc(Nc2cccc(-c3cnc(C(=O)CCC(=O)O)s3)n2)c1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SYK P43405 8/20 0.56
KARS1 Q15046 8/20 0.52
KDR P35968 1/20 0.46
JAK2 O60674 1/20 0.43
CES1 P23141 2/20 0.43

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
SCHEMBL2868318 0.87 SYK (0.51) SYKKARS1KDRJAK2
SCHEMBL13136135 0.85 SYK (0.51) SYKKARS1KDRJAK2
SCHEMBL2865910 0.85 KARS1 (0.58) SYKKARS1KDRJAK2
SCHEMBL13136168 0.84 SYK (0.54) SYKKARS1KDRJAK2
SCHEMBL13136320 0.84 SYK (0.55) SYKKARS1KDRJAK2
SCHEMBL2865358 0.83 SYK (0.53) SYKKARS1KDRJAK2
SCHEMBL13136090 0.83 KARS1 (0.56) SYKKARS1KDRJAK2
SCHEMBL2866521 0.83 KARS1 (0.56) SYKKARS1KDRJAK2
SCHEMBL2870139 0.83 KARS1 (0.53) SYKKARS1KDRJAK2
SCHEMBL13136134 0.83 SYK (0.51) SYKKARS1KDRJAK2

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