SCHEMBL7367119

SCHEMBL7367119

COc1scc(C)c1-c1nc(C)c(-c2ccncc2)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.39
MAPK13 O15264 8/20 0.39
MAPK12 P53778 8/20 0.39
MAPK11 Q15759 8/20 0.39
RAF1 P04049 6/20 0.39
DYRK1A Q13627 3/20 0.39
TEK Q02763 3/20 0.38
GCGR P47871 2/20 0.38
ALOX5 P09917 2/20 0.38
CSNK1D P48730 3/20 0.37
CSNK1E P49674 2/20 0.37
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
MAPK9 P45984 1/20 0.35
CSNK1A1 P48729 1/20 0.35
CLK2 P49760 1/20 0.35
CSNK1G1 Q9HCP0 1/20 0.35

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
SCHEMBL7375478 0.87 CYP11B1 (0.43) RAF1
SCHEMBL7372687 0.79 MAPK13 (0.39) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL9634600 0.78 PDE5A (0.40)
Hydrochloric Acid SCHEMBL9838295 0.77 PDE5A (0.41)
SCHEMBL19868943 0.73 MAPK14 (0.67) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL7377115 0.72 NPY5R (0.57)
SCHEMBL10739483 0.70 METAP2 (0.39)
SCHEMBL10917045 0.70 AMY1A (0.33)
Hydrochloric Acid SCHEMBL10743666 0.69 AMY1A (0.33)
SCHEMBL7372971 0.68 NPY5R (0.41)

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-4822805-A ANTIINFLAMMATORY AGENTS, CARDIOTONIC AGENTS, ANTIPLATELET AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-04-18 US disclosed
EP-0257897-A1 Imidazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-03-02 EP disclosed