SCHEMBL2196134

SCHEMBL2196134

CS(=O)(=O)c1ccc(C(O)c2cc3cccnc3[nH]2)cc1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GCK P35557 13/20 0.47
DAO P14920 1/20 0.42
RIPK1 Q13546 4/20 0.40
MET P08581 1/20 0.38
HRH4 Q9H3N8 1/20 0.37
HRH3 Q9Y5N1 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
SCHEMBL1959200 0.81 GCK (0.51) GCKRIPK1
SCHEMBL1960655 0.80 GCK (0.52) GCK
SCHEMBL12490119 0.78 GCK (0.46) GCKRIPK1
SCHEMBL2195791 0.78 GCK (0.44) GCKDAORIPK1MET
SCHEMBL1962013 0.77 GCK (0.75) GCK
SCHEMBL2199152 0.76 GCK (0.73) GCK
SCHEMBL2197752 0.74 GCK (0.40) GCK
SCHEMBL1964350 0.74 GCK (0.63) GCK
SCHEMBL1961224 0.74 GCK (0.63) GCK
SCHEMBL29460593 0.73 DAO (0.50) GCKDAORIPK1HRH4HRH3

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
WO-2011080755-A1 FUSED NITROGEN HETEROCYCLIC COMPOUNDS, PROCESS OF PREPARATION AND USES THEREOF ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2011-07-07 WO disclosed