SCHEMBL14767490

SCHEMBL14767490

COc1ccc(-c2cnc3c(NCc4ccc(CO)cc4)nccn23)cc1C

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TTK P33981 11/20 0.47
ZAP70 P43403 1/20 0.42
KARS1 Q15046 1/20 0.42
ADORA3 P0DMS8 3/20 0.41
FYN P06241 3/20 0.41
PDE10A Q9Y233 1/20 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
SCHEMBL2178662 0.92 TTK (0.48) TTKZAP70KARS1ADORA3FYN
SCHEMBL14767505 0.90 ADORA3 (0.46) TTKADORA3FYNPDE10A
SCHEMBL2182480 0.86 ZAP70 (0.46) TTKZAP70KARS1FYN
SCHEMBL14767524 0.86 TTK (0.43) TTKZAP70KARS1FYN
SCHEMBL12409298 0.82 MAPK1 (0.48) TTKADORA3FYNPDE10A
SCHEMBL12409242 0.82 TTK (0.56) TTKADORA3FYN
SCHEMBL2179881 0.81 CFTR (0.54) TTKZAP70KARS1ADORA3FYN
SCHEMBL2178112 0.81 TTK (0.56) TTKZAP70KARS1FYN
SCHEMBL3469243 0.81 ADORA3 (0.51) TTKZAP70KARS1ADORA3FYN
SCHEMBL14668744 0.81 FYN (0.51) TTKFYN

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2567960-A2 Imidazo[1,2-a]pyrazine compounds for treatment of viral infections such as hepatitis Biofocus DPI Limited (GB) 2013-03-13 EP disclosed