SCHEMBL14646331

SCHEMBL14646331

Bc1ccc(-c2nc3sccn3c2CO)cc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.54
NR1I3 Q14994 18/20 0.47
PRKD3 O94806 1/20 0.42
MAP4K4 O95819 1/20 0.42
FGFR1 P11362 1/20 0.42
FRK P42685 1/20 0.42
MAPK8 P45983 1/20 0.42
MAPK9 P45984 1/20 0.42
CSNK1A1 P48729 1/20 0.42
CSNK1D P48730 1/20 0.42
GSK3B P49841 1/20 0.42
CSNK1G2 P78368 1/20 0.42
PRKCD Q05655 1/20 0.42
ERBB4 Q15303 1/20 0.42
MINK1 Q8N4C8 1/20 0.42
PRKD2 Q9BZL6 1/20 0.42
CSNK1G1 Q9HCP0 1/20 0.42
MAP3K20 Q9NYL2 1/20 0.42
CSNK1G3 Q9Y6M4 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
SCHEMBL1691880 0.86 NR1I3 (0.56) DYRK1ANR1I3
SCHEMBL1691378 0.86 NR1I3 (0.62) DYRK1ANR1I3
SCHEMBL1691688 0.86 NR1I3 (0.57) DYRK1ANR1I3PRKD3MAP4K4FGFR1
SCHEMBL1692245 0.86 NR1I3 (0.55) DYRK1ANR1I3
SCHEMBL22648873 0.85 DYRK1A (0.56) DYRK1ANR1I3
SCHEMBL2553052 0.84 NR1I3 (0.61) DYRK1ANR1I3
SCHEMBL22627537 0.71 NR1I3 (0.62) NR1I3
SCHEMBL20078261 0.71 IDO1 (0.57) NR1I3
SCHEMBL1691260 0.70 DYRK1A (0.56) DYRK1ANR1I3
SCHEMBL3757641 0.70 DYRK1A (1.00) DYRK1ANR1I3

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-2376490-B1 IMIDAZOPYRIDINE COMPOUNDS PROXIMAGEN LTD (GB) 2013-01-23 EP disclosed