SCHEMBL11274609

SCHEMBL11274609

COc1cc(NC(=O)NS(=O)(=O)c2ccccc2C)nc(OC)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.51
HSD17B10 Q99714 1/20 0.51
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
CYP1A2 P05177 1/20 0.49
ALDH1A1 P00352 3/20 0.48
KMT2A Q03164 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
AKT1 P31749 1/20 0.48
HTT P42858 1/20 0.48
TP53 P04637 1/20 0.48
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
CASP3 P42574 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
FBP1 P09467 1/20 0.47
P2RY1 P47900 1/20 0.46

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
SCHEMBL11276176 0.88 ALDH1A1 (0.53) NPC1RAB9ACYP1A2ALDH1A1KMT2A
SCHEMBL11498392 0.85 KMT2A (0.57) GAAHSD17B10NPC1RAB9ACYP1A2
SCHEMBL11275782 0.84 NPC1 (0.47) NPC1RAB9ACYP1A2ALDH1A1KMT2A
SCHEMBL10364805 0.81 KMT2A (0.58) GAAALDH1A1KMT2ASMN1; SMN2AKT1
SCHEMBL11560856 0.81 GAA (0.55) GAASMN1; SMN2HTTTP53FBP1
SCHEMBL19034718 0.79 FBP1 (0.48) GAANPC1ALDH1A1FBP1CA12
SCHEMBL11154432 0.78 FBP1 (0.47) GAANPC1ALDH1A1FBP1CA12
SCHEMBL11153823 0.77 GAA (0.51) GAANPC1ALDH1A1SMN1; SMN2TP53
SCHEMBL11182712 0.76 KDM4E (0.44) GAAHSD17B10ALDH1A1KMT2ACA12
SCHEMBL11156724 0.76 FBP1 (0.45) GAANPC1ALDH1A1KMT2AFBP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0001485-B1 HERBICIDAL SULPHONAMIDES, THEIR PREPARATION, COMPOSITIONS CONTAINING THEM AND USE THEREOF E.I. DU PONT DE NEMOURS AND COMPANY (US) 1982-05-12 EP claimed
US-4221585-A N-[(2,6-Dimethoxypyrimidin-4-yl)]aminocarbonyl benzene sulfonamides and their herbicidal compositions and methods of use E. I. DU PONT DE NEMOURS AND COMPANY (US) 1980-09-09 US claimed
EP-0001485-A2 Herbicidal sulphonamides, their preparation, compositions containing them and use thereof E.I. DU PONT DE NEMOURS AND COMPANY (US) 1979-04-18 EP claimed
EP-0001485-B1 HERBICIDAL SULPHONAMIDES, THEIR PREPARATION, COMPOSITIONS CONTAINING THEM AND USE THEREOF E.I. DU PONT DE NEMOURS AND COMPANY (US) 1982-05-12 EP disclosed
US-4221585-A N-[(2,6-Dimethoxypyrimidin-4-yl)]aminocarbonyl benzene sulfonamides and their herbicidal compositions and methods of use E. I. DU PONT DE NEMOURS AND COMPANY (US) 1980-09-09 US disclosed
US-4221585-A N-[(2,6-Dimethoxypyrimidin-4-yl)]aminocarbonyl benzene sulfonamides and their herbicidal compositions and methods of use E. I. DU PONT DE NEMOURS AND COMPANY (US) 1980-09-09 US disclosed
EP-0001485-A2 Herbicidal sulphonamides, their preparation, compositions containing them and use thereof E.I. DU PONT DE NEMOURS AND COMPANY (US) 1979-04-18 EP disclosed