SCHEMBL5329554

SCHEMBL5329554

O=S(=O)(NCc1ccccc1)c1nc2ccccc2s1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB8 P28062 1/20 0.57
PSMB5 P28074 1/20 0.57
L3MBTL1 Q9Y468 2/20 0.56
CA2 P00918 3/20 0.55
CA12 O43570 2/20 0.55
CA7 P43166 2/20 0.55
CA14 Q9ULX7 2/20 0.55
CA1 P00915 2/20 0.55
CA4 P22748 1/20 0.55
KEAP1 Q14145 1/20 0.51
ALDH1A1 P00352 5/20 0.51
MAPT P10636 3/20 0.51
LMNA P02545 2/20 0.51
HTT P42858 2/20 0.51
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.49
HPGD P15428 2/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49

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
SCHEMBL8417368 0.83 PSMB8 (0.58) PSMB8PSMB5L3MBTL1CA2CA12
SCHEMBL3282188 0.81 PSMB8 (0.55) PSMB8PSMB5L3MBTL1CA2CA12
SCHEMBL4357765 0.80 PSMB8 (0.51) PSMB8PSMB5L3MBTL1CA2CA12
SCHEMBL10700457 0.79 ALDH1A1 (0.63) PSMB8PSMB5L3MBTL1CA2CA12
SCHEMBL31546243 0.78 PSMB8 (0.53) PSMB8PSMB5L3MBTL1CA2CA12
SCHEMBL8799542 0.78 CA1 (0.55) PSMB8PSMB5L3MBTL1CA2CA12
SCHEMBL4883388 0.78 PSMB8 (0.53) PSMB8PSMB5L3MBTL1CA2CA12
SCHEMBL8229512 0.78 PSMB8 (0.64) PSMB8PSMB5L3MBTL1CA2CA12
SCHEMBL10474769 0.78 PSMB8 (0.64) PSMB8PSMB5L3MBTL1CA2CA12
SCHEMBL21873110 0.77 PSMB8 (0.51) PSMB8PSMB5L3MBTL1CA2CA12

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
WO-2007138112-A2 COMPOUNDS THAT INTERACT WITH ION CHANNELS, IN PARTICULAR WITH ION CHANNELS FROM THE KV FAMILY DEVGEN N.V. (BE) 2007-12-06 WO claimed
WO-2007138112-A2 COMPOUNDS THAT INTERACT WITH ION CHANNELS, IN PARTICULAR WITH ION CHANNELS FROM THE KV FAMILY DEVGEN N.V. (BE) 2007-12-06 WO disclosed