SCHEMBL9682940

SCHEMBL9682940

COC(=O)c1ccccc1S(=O)(=O)NN=C(Nc1nc(OC)nc(OC)n1)NS(=O)(=O)c1ccccc1SC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
TSHR P16473 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GAA P10253 2/20 0.37
NPC1 O15118 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA5A P35218 1/20 0.37
CA9 Q16790 1/20 0.37
SLC40A1 Q9NP59 1/20 0.37
MAPT P10636 1/20 0.35
PTPN2 P17706 1/20 0.35
PTPN1 P18031 1/20 0.35
PTPN5 P54829 1/20 0.35
POLB P06746 1/20 0.35
F2 P00734 1/20 0.34
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34

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
SCHEMBL9479411 0.92 KMT2A (0.43) MEN1KMT2ATDP1GAANPC1
SCHEMBL9683301 0.87 CA1 (0.40) MEN1KMT2ATDP1GAANPC1
SCHEMBL9683305 0.87 KMT2A (0.40) MEN1KMT2ATDP1GAANPC1
SCHEMBL9684036 0.86 NPC1 (0.40) MEN1KMT2AGAANPC1CA1
SCHEMBL9478676 0.82 MAPT (0.37) MEN1KMT2ATSHRL3MBTL1GAA
SCHEMBL9477385 0.81 KMT2A (0.36) MEN1KMT2AGAANPC1CA1
SCHEMBL9682816 0.81 NPC1 (0.38) MEN1KMT2AGAANPC1CA1
SCHEMBL9587331 0.81 KMT2A (0.43) MEN1KMT2ATDP1GAANPC1
SCHEMBL9684536 0.81 NPC1 (0.42) MEN1KMT2AGAANPC1CA1
SCHEMBL9478712 0.80 ALDH1A1 (0.36) MEN1KMT2AGAANPC1CA1

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-0499096-A1 Substituted arylsulfonylaminoguanidinotriazines BAYER AG (DE) 1992-08-19 EP claimed
EP-0499096-A1 Substituted arylsulfonylaminoguanidinotriazines BAYER AG (DE) 1992-08-19 EP disclosed
EP-0499096-A1 Substituted arylsulfonylaminoguanidinotriazines BAYER AG (DE) 1992-08-19 EP disclosed