SCHEMBL11047586

SCHEMBL11047586

COCc1ccccc1S(=O)(=O)NC(=O)Nc1nc(C)nc(OC)n1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
MAPT P10636 1/20 0.45
GAA P10253 1/20 0.39
NAMPT P43490 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
TP53 P04637 1/20 0.36
CDK1 P06493 1/20 0.36
FBP1 P09467 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35

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
SCHEMBL11044864 0.93 ALDH1A1 (0.49) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL11047395 0.92 ALDH1A1 (0.45) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL26761188 0.91 ALDH1A1 (0.53) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL11122289 0.90 ALDH1A1 (0.47) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL10680118 0.90 ALDH1A1 (0.45) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL11043191 0.88 ALDH1A1 (0.46) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL11040338 0.88 MAPT (0.46) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL6459389 0.88 ALDH1A1 (0.47) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL11050852 0.88 ALDH1A1 (0.45) ALDH1A1KDM4ENPC1MAPTGAA
SCHEMBL11341411 0.87 MAPT (0.45) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0044209-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-10-31 EP claimed
US-4348220-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-09-07 US claimed
EP-0044209-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-10-31 EP disclosed
US-4424377-A HERBICIDES E. I. DU PONT DE NEMOURS & CO. (US) 1984-01-03 US disclosed
US-4348220-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-09-07 US disclosed
EP-0044209-A1 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1982-01-20 EP disclosed