SCHEMBL13136646

SCHEMBL13136646

Cc1ccnc(Nc2cccc(-c3ccc(CNCCC(=O)O)s3)n2)c1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 12/20 0.48
SYK P43405 2/20 0.46
JAK2 O60674 1/20 0.42
KDR P35968 1/20 0.40
S1PR5 Q9H228 3/20 0.39
S1PR4 O95977 2/20 0.39

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
SCHEMBL13136200 0.87 SYK (0.53) KARS1SYKJAK2KDR
SCHEMBL2863219 0.84 KARS1 (0.46) KARS1SYKJAK2KDRS1PR5
SCHEMBL13136629 0.83 KARS1 (0.48) KARS1SYKJAK2
SCHEMBL13136556 0.82 KARS1 (0.53) KARS1SYKKDR
SCHEMBL2859009 0.82 KARS1 (0.45) KARS1SYKJAK2KDR
SCHEMBL13136662 0.82 SYK (0.50) KARS1SYK
Hydrochloric Acid SCHEMBL2865736 0.81 KARS1 (0.45) KARS1SYKJAK2KDR
SCHEMBL2872532 0.81 KARS1 (0.57) KARS1SYKJAK2KDR
SCHEMBL13136613 0.80 KARS1 (0.55) KARS1SYKKDR
SCHEMBL2868318 0.80 SYK (0.51) KARS1SYKJAK2KDR

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