SCHEMBL7767929

SCHEMBL7767929

O=S(=O)(F)CCN(CCS(=O)(=O)F)c1ccc(/N=N/c2ccc(S(=O)(=O)F)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 8/20 0.41
CA2 P00918 8/20 0.41
CA9 Q16790 8/20 0.41
POLB P06746 2/20 0.41
MEN1 O00255 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
KMT2A Q03164 2/20 0.41
F2 P00734 5/20 0.36
PRSS1 P07477 3/20 0.36
PRSS2 P07478 3/20 0.36
PRSS3 P35030 3/20 0.36
CYP2D6 P10635 2/20 0.34
TSHR P16473 2/20 0.34
TMPRSS4 Q9NRS4 2/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
ALDH1A1 P00352 1/20 0.34
ALOX15 P16050 1/20 0.34
CA7 P43166 2/20 0.33

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
SCHEMBL7767931 1.00 CA12 (0.41) CA12CA2CA9POLBMEN1
SCHEMBL7772208 0.91 KMT2A (0.40) CA12CA2CA9POLBMEN1
SCHEMBL7772206 0.91 KMT2A (0.40) CA12CA2CA9POLBMEN1
SCHEMBL7769130 0.84 NPC1 (0.41) CA12CA2CA9POLBMEN1
SCHEMBL7769131 0.84 NPC1 (0.41) CA12CA2CA9POLBMEN1
SCHEMBL7768216 0.81 MAPT (0.48) CA12CA2CA9POLBMEN1
SCHEMBL7768219 0.81 MAPT (0.48) CA12CA2CA9POLBMEN1
SCHEMBL7764334 0.75 NPC1 (0.69) CA12CA2CA9POLBMEN1
SCHEMBL7764335 0.75 NPC1 (0.69) CA12CA2CA9POLBMEN1
SCHEMBL7768058 0.72 NPC1 (0.44) CA12CA2CA9POLBMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0740690-B1 MONOAZO DYES CONTAINING A FLUOROSULPHONYL GROUP AND USE THEREOF SYNGENTA LTD (GB) 2001-06-20 EP claimed
EP-0740690-B1 MONOAZO DYES CONTAINING A FLUOROSULPHONYL GROUP AND USE THEREOF SYNGENTA LTD (GB) 2001-06-20 EP disclosed
US-5739299-A GOOD WET FASTNESS AND LIGHT FASTNESS PROPERTIES ZENECA LIMITED (GB) 1998-04-14 US disclosed