SCHEMBL9823087

SCHEMBL9823087

Cn1nnc(-c2ccccc2S(=O)(=O)Cl)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.42
HSD11B1 P28845 1/20 0.38
AGTR1 P30556 1/20 0.35
AGTR2 P50052 1/20 0.35
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
HPGD P15428 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ACLY P53396 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ABCG2 Q9UNQ0 3/20 0.33
EPHX2 P34913 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL9823051 0.84 PDK2 (0.42) PDK2EPHX2
SCHEMBL9822973 0.72 HSD11B1 (0.44) HSD11B1AGTR1AGTR2ACLYSMN1; SMN2
SCHEMBL2647877 0.71 PDK2 (0.50) PDK2HPGDSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL7127239 0.71 ALDH1A1 (0.48) HSD11B1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL15401417 0.71 PDK2 (0.33) PDK2EPHX2
SCHEMBL8936373 0.71 EDNRA (0.47) ALDH1A1HSD17B10TDP1
SCHEMBL5504833 0.70 PDK2 (0.46) PDK2NPC1RAB9AHPGDSMN1; SMN2
SCHEMBL10248780 0.70 ACLY (0.53) NPC1RAB9AACLYNFKB1NFKB2
SCHEMBL8213584 0.69 PDK2 (0.48) PDK2HPGDL3MBTL1NFKB1NFKB2
SCHEMBL13846219 0.69 NPSR1 (0.58) PDK2HSD11B1NPC1RAB9AL3MBTL1

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-0204513-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-07-17 EP disclosed
US-5017214-A Herbicidal sulfonamides LEVITT GEORGE (US) 1991-05-21 US disclosed
US-4913726-A PLANT GROWTH REGULATORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-04-03 US disclosed
US-4786311-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-11-22 US disclosed
US-4746353-A Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-05-24 US disclosed
EP-0204513-A2 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1986-12-10 EP disclosed