SCHEMBL11076508

SCHEMBL11076508

COC(=O)c1ccccc1S(=O)(=O)NC(=O)Nc1nc(C)c(Br)c(C)n1

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.48
GAA P10253 1/20 0.48
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA5A P35218 1/20 0.46
CA9 Q16790 1/20 0.46
SLC40A1 Q9NP59 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
BRD4 O60885 1/20 0.43
FBP1 P09467 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 2/20 0.42

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
SCHEMBL11057471 0.91 NPC1 (0.50) NPC1GAACA1CA2CA5A
SCHEMBL11051029 0.88 NPC1 (0.48) NPC1GAACA1CA2CA5A
SCHEMBL11076663 0.88 NPC1 (0.48) NPC1GAACA1CA2CA5A
SCHEMBL11068028 0.88 CA2 (0.47) NPC1CA1CA2CA9BRD4
SCHEMBL10510466 0.87 NPC1 (0.51) NPC1GAACA1CA2CA5A
SCHEMBL11069326 0.86 NPC1 (0.48) NPC1GAACA1CA2CA5A
SCHEMBL10507288 0.86 NPC1 (0.48) NPC1GAACA1CA2CA5A
Sulfometuron Methyl SCHEMBL54998 0.86 GAA (0.50) NPC1GAACA1CA2CA5A
Sulfometuron Methyl SCHEMBL9137833 0.86 GAA (0.50) NPC1GAACA1CA2CA5A
Sulfometuron Methyl SCHEMBL27545620 0.86 GAA (0.50) NPC1GAACA1CA2CA5A

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
EP-0023140-B1 HERBICIDAL SULFONAMIDES, PREPARATION AND USE THEREOF, AND COMPOSITIONS CONTAINING THEM E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-10-31 EP claimed
EP-0023140-A2 Herbicidal sulfonamides, preparation and use thereof, and compositions containing them E.I. DU PONT DE NEMOURS AND COMPANY (US) 1981-01-28 EP claimed
EP-0023140-B1 HERBICIDAL SULFONAMIDES, PREPARATION AND USE THEREOF, AND COMPOSITIONS CONTAINING THEM E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-10-31 EP disclosed
US-4342587-A Herbicidal pyridinsulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-08-03 US disclosed
EP-0023140-A2 Herbicidal sulfonamides, preparation and use thereof, and compositions containing them E.I. DU PONT DE NEMOURS AND COMPANY (US) 1981-01-28 EP disclosed