SCHEMBL16296752

SCHEMBL16296752

CS(=O)(=O)NC(=O)c1[c]cccn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 2/20 0.40
MYC P01106 1/20 0.36
PTGS2 P35354 5/20 0.34
P2RX7 Q99572 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SCN9A Q15858 4/20 0.33
HTT P42858 2/20 0.32
PKM P14618 1/20 0.32
EGFR P00533 1/20 0.32
PTGS1 P23219 2/20 0.32
ALOX15 P16050 1/20 0.32
GLO1 Q04760 1/20 0.32
SCN5A Q14524 2/20 0.32
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIA1 P42261 1/20 0.31
GRIA2 P42262 1/20 0.31
GRIA3 P42263 1/20 0.31
GRIA4 P48058 1/20 0.31

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
SCHEMBL2066868 0.80 PLK1 (0.39) P2RX7HTTLMNATDP1
SCHEMBL28280293 0.78 HDAC1 (0.40) P2RX7ALOX15
SCHEMBL497105 0.74
SCHEMBL128093 0.73 L3MBTL1 (0.41) HTTPKMALOX15TDP1
SCHEMBL35207 0.71
SCHEMBL28177793 0.71 SMYD3 (0.43) MEN1KMT2A
SCHEMBL29029414 0.70 PTGS2 (0.66) P4HTMPTGS2HTTPKMPTGS1
SCHEMBL894826 0.70
SCHEMBL1031112 0.70
SCHEMBL3936326 0.69 ALDH1A1 (0.34) MEN1KMT2AHTT

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-2014200885-A1 PDE10a INHIBITORS FOR THE TREATMENT OF TYPE II DIABETES JANSSEN PHARMACEUTICA NV (BE) 2014-12-18 WO disclosed