SCHEMBL13136205

SCHEMBL13136205

Cc1ccnc(Nc2cccc(-c3cnc([C@@H](N)Cc4ccc(NC(=O)OCc5ccccc5)cc4)s3)n2)c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.43
KDR P35968 2/20 0.42
AURKA O14965 1/20 0.42
FLT3 P36888 1/20 0.42
KARS1 Q15046 7/20 0.42
MAP3K5 Q99683 1/20 0.39
P2RX3 P56373 1/20 0.38
POLB P06746 1/20 0.38
BLK P51451 1/20 0.37
BTK Q06187 1/20 0.37
ROCK2 O75116 1/20 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
SCHEMBL13136213 0.89 SYK (0.41) SYKKDRAURKAFLT3KARS1
SCHEMBL13136033 0.87 KARS1 (0.53) SYKKDRKARS1JAK2MEN1
SCHEMBL13136375 0.84 KARS1 (0.48) SYKKDRKARS1POLBJAK2
SCHEMBL13136041 0.82 KARS1 (0.50) SYKKDRKARS1JAK2MEN1
SCHEMBL13136210 0.82 KARS1 (0.52) SYKKDRKARS1POLBMEN1
SCHEMBL2865508 0.79 KARS1 (0.52) SYKKDRKARS1JAK2MEN1
SCHEMBL13136174 0.78 KARS1 (0.46) SYKKDRKARS1MEN1KMT2A
SCHEMBL13136211 0.78 NPC1 (0.49) SYKKDRKARS1MEN1KMT2A
SCHEMBL13136134 0.78 SYK (0.51) SYKKDRKARS1JAK2
SCHEMBL13136039 0.77 SYK (0.49) SYKKDRKARS1JAK2MEN1

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