SCHEMBL1831060

SCHEMBL1831060

NC(NCc1ccccn1)NS(=O)(=O)c1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.47
SLC1A2 P43004 1/20 0.47
SLC1A1 P43005 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 3/20 0.42
HSD17B10 Q99714 2/20 0.42
HPGD P15428 2/20 0.42
CASP1 P29466 1/20 0.42
CASP7 P55210 1/20 0.42
CTDSP1 Q9GZU7 1/20 0.42
PRMT1 Q99873 1/20 0.41
EDNRB P24530 2/20 0.41
EDNRA P25101 2/20 0.41
MAPT P10636 1/20 0.41
SCN1A P35498 2/20 0.41
SCN2A Q99250 2/20 0.41
SCN3A Q9NY46 2/20 0.41
CYP1A2 P05177 1/20 0.41

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
SCHEMBL169187 0.81 L3MBTL1 (0.60) L3MBTL1KDM4EALDH1A1HSD17B10HPGD
Pyrabactin A SCHEMBL2476266 0.72 ALDH1A1 (0.50) L3MBTL1KDM4EALDH1A1HSD17B10HPGD
SCHEMBL12658168 0.71 F2 (0.54) SMN1; SMN2KDM4EALDH1A1MAPTF2
SCHEMBL1833222 0.71 F2 (0.54) SMN1; SMN2KDM4EALDH1A1MAPTF2
SCHEMBL1833219 0.71 F2 (0.54) SMN1; SMN2KDM4EALDH1A1MAPTF2
SCHEMBL6006417 0.70 SLC1A3 (0.61) SLC1A3SLC1A2SLC1A1KDM4EALDH1A1
SCHEMBL4443025 0.70 NSD2 (0.65) L3MBTL1KDM4EALDH1A1HSD17B10HPGD
SCHEMBL9468163 0.70 SLC1A3 (0.64) SLC1A3SLC1A2SLC1A1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL4446948 0.69 NSD2 (0.66) L3MBTL1KDM4EALDH1A1HSD17B10HPGD
SCHEMBL7768609 0.68 KDM4E (0.67) SMN1; SMN2KDM4EALDH1A1HSD17B10HPGD

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
EP-1320520-B1 SULFONYLGUANIDINE GRUENENTHAL GMBH (DE) 2011-05-11 EP claimed