SCHEMBL8535445

SCHEMBL8535445

COCCOc1ccccc1S(=O)(=O)NC(=O)Nc1nc(OC)nc(OC)n1.COCCOc1ccccc1S(=O)(=O)NC(=O)Nc1nc(OC)nc(OC)n1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
KDM4E B2RXH2 1/20 0.49
NPC1 O15118 1/20 0.49
MAPT P10636 1/20 0.48
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.39
TP53 P04637 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
RXFP1 Q9HBX9 2/20 0.37
NAMPT P43490 1/20 0.37

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
SCHEMBL54807 1.00 ALDH1A1 (0.49) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL29373703 1.00 ALDH1A1 (0.49) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL11088562 0.95 ALDH1A1 (0.57) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL10383232 0.94 ALDH1A1 (0.46) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL11088505 0.92 ALDH1A1 (0.61) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL10455416 0.92 MAPT (0.46) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL10382723 0.91 ALDH1A1 (0.52) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL10755688 0.91 MAPT (0.50) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL10854974 0.91 ATM (0.45) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL10915090 0.90 ALDH1A1 (0.51) ALDH1A1KDM4ENPC1MAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0574418-B1 ARYL SULPHONYL UREA COMPOUNDS, A METHOD OF PREPARING THEM, AND THEIR USE AS HERBICIDES AND GROWTH REGULATORS HOECHST SCHERING AGREVO GMBH (DE) 1998-11-11 EP disclosed
US-5463081-A Chemical intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1995-10-31 US disclosed
EP-0574418-A1 ARYL SULPHONYL UREA COMPOUNDS, A METHOD OF PREPARING THEM, AND THEIR USE AS HERBICIDES AND GROWTH REGULATORS Hoechst Schering AgrEvo GmbH (DE) 1993-12-22 EP disclosed
WO-1992013845-A1 ARYL SULPHONYL UREA COMPOUNDS, A METHOD OF PREPARING THEM, AND THEIR USE AS HERBICIDES AND GROWTH REGULATORS HOECHST AKTIENGESELLSCHAFT (DE) 1992-08-20 WO disclosed