SCHEMBL10694395

SCHEMBL10694395

O=C=NS(=O)(=O)c1ccccc1CCBr

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.31
PLCG1 P19174 1/20 0.31
GABRA1 P14867 1/20 0.30
GABRB2 P47870 1/20 0.30

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
SCHEMBL10690933 0.83 GABRA1 (0.30) GABRA1GABRB2
SCHEMBL1945878 0.81 CYP3A4 (0.37) TDP1GABRA1GABRB2
SCHEMBL10383754 0.80 HSD11B1 (0.31)
SCHEMBL27527586 0.80 LIPG (0.41)
SCHEMBL8549823 0.79 GABRA1 (0.32) GABRA1GABRB2
SCHEMBL10646473 0.79 GABRA1 (0.35) GABRA1GABRB2
SCHEMBL6677573 0.78 GAA (0.36) PLCG1
Cyanide SCHEMBL27388351 0.76 LIPG (0.39)
SCHEMBL11067005 0.75 MMP2 (0.51) TDP1
SCHEMBL11049036 0.75 CTSB (0.34) TDP1GABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4770690-A Herbicidal ortho-alkyl- and ortho-alkenyl-substituted benzenesulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-09-13 US disclosed
EP-0106512-B1 HERBICIDAL ORTHO-ALKYL- AND ORTHO-ALKENYL-SUBSTITUTED BENZENESULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-05-18 EP disclosed
US-4699650-A Herbicidal ortho-alkyl-and ortho-alkenyl substituted benzenesulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-10-13 US disclosed
US-4678502-A PLANT GROWTH REGULATORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-07-07 US disclosed
EP-0106512-A2 Herbicidal ortho-alkyl- and ortho-alkenyl-substituted benzenesulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-04-25 EP disclosed