SCHEMBL13136608

SCHEMBL13136608

CC(=O)N1CCN(C(=O)c2ccc(-c3cccc(Nc4cc(C)ccn4)n3)s2)CC1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 11/20 0.47
SYK P43405 2/20 0.46
MAP3K12 Q12852 5/20 0.45
NTRK1 P04629 1/20 0.42
KDR P35968 1/20 0.42

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
SCHEMBL13136602 0.90 RAB9A (0.49) KARS1SYKMAP3K12
SCHEMBL2868322 0.90 KARS1 (0.56) KARS1SYKMAP3K12NTRK1
SCHEMBL13136599 0.89 KARS1 (0.49) KARS1SYKMAP3K12
SCHEMBL13136661 0.87 SYK (0.51) KARS1SYKMAP3K12
SCHEMBL13136658 0.85 SYK (0.48) KARS1SYKMAP3K12
SCHEMBL2864883 0.85 KARS1 (0.56) KARS1SYKKDR
SCHEMBL2864564 0.83 SYK (0.51) KARS1SYKMAP3K12KDR
SCHEMBL13136552 0.82 KARS1 (0.56) KARS1SYKKDR
SCHEMBL13177725 0.82 SYK (0.48) KARS1SYKMAP3K12
SCHEMBL2869562 0.81 KARS1 (0.55) KARS1SYKKDR

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