SCHEMBL13136189

SCHEMBL13136189

CC(=O)N[C@H](c1ccc(OCc2ccccc2)cc1)c1ncc(-c2cccc(Nc3cc(C)ccn3)n2)s1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P4HB P07237 1/20 0.46
SYK P43405 2/20 0.45
KARS1 Q15046 6/20 0.42
SLC2A1 P11166 1/20 0.40
ACACB O00763 4/20 0.40
ACACA Q13085 1/20 0.40
KDR P35968 1/20 0.39
GBA1 P04062 1/20 0.38
PPARD Q03181 2/20 0.37
PPARA Q07869 2/20 0.37
JAK2 O60674 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL13136095 0.89 SYK (0.44) P4HBSYKKARS1ACACBPPARD
SCHEMBL2866182 0.88 SYK (0.48) SYKKARS1KDRJAK2MEN1
SCHEMBL2866177 0.88 SYK (0.48) SYKKARS1KDRJAK2MEN1
SCHEMBL13136185 0.86 KARS1 (0.47) P4HBSYKKARS1SLC2A1KDR
SCHEMBL13136042 0.85 SYK (0.46) SYKKARS1KDRJAK2MEN1
SCHEMBL13136087 0.83 ACACB (0.44) SYKACACBACACAKDRPPARD
SCHEMBL13136039 0.83 SYK (0.49) SYKKARS1KDRJAK2MEN1
SCHEMBL13136094 0.82 KARS1 (0.46) P4HBSYKKARS1SLC2A1KDR
SCHEMBL13136092 0.82 PTPRB (0.50) SYKKARS1JAK2KMT2A
SCHEMBL13136120 0.81 SYK (0.44) SYKKARS1KDRJAK2MEN1

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