SCHEMBL13136397

SCHEMBL13136397

Cc1ccnc(Nc2cccc(-c3cnc(N4CCN(C(=O)C5CCC(O)CC5)CC4)s3)n2)c1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SYK P43405 10/20 0.50
KARS1 Q15046 7/20 0.47
TP53 P04637 2/20 0.46
MAPT P10636 2/20 0.46
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAP3K12 Q12852 1/20 0.41

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
SCHEMBL13136402 0.93 SYK (0.50) SYKKARS1MAP3K12
SCHEMBL2861431 0.89 KARS1 (0.55) SYKKARS1
SCHEMBL13136490 0.88 SYK (0.48) SYKKARS1NPC1RAB9A
SCHEMBL13136418 0.88 SYK (0.49) SYKKARS1MAPTNPC1RAB9A
SCHEMBL13136405 0.88 SYK (0.51) SYKKARS1MAP3K12
SCHEMBL2864564 0.87 SYK (0.51) SYKKARS1MAP3K12
SCHEMBL2862879 0.86 SYK (0.49) SYKKARS1MAPTNPC1RAB9A
SCHEMBL13136408 0.85 SYK (0.49) SYKKARS1
SCHEMBL2870170 0.85 SYK (0.49) SYKKARS1
SCHEMBL2859023 0.85 SYK (0.57) SYKKARS1

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