SCHEMBL10567657

SCHEMBL10567657

Cc1nc(C)nc(NC(=O)NS(=O)(=O)c2c(C(=O)O)n(C)c3ccccc23)n1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ACLY P53396 1/20 0.39
TSHR P16473 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
POLB P06746 1/20 0.37
MCL1 Q07820 1/20 0.37
GFER P55789 1/20 0.36
FBP1 P09467 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 1/20 0.35
ALOX15 P16050 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
SCHEMBL10565372 0.91 ALDH1A1 (0.42) KDM4EALDH1A1HPGDHSD17B10ACLY
SCHEMBL10565455 0.90 GAA (0.43) KDM4EALDH1A1HPGDHSD17B10ACLY
SCHEMBL10565848 0.86 ALDH1A1 (0.45) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL10569523 0.85 GAA (0.51) KDM4EALDH1A1HPGDHSD17B10ACLY
SCHEMBL10566127 0.84 SMN1; SMN2 (0.46) KDM4EALDH1A1HPGDHSD17B10ACLY
SCHEMBL11041438 0.81 KDM4E (0.39) KDM4EALDH1A1HPGDHSD17B10ACLY
SCHEMBL10567289 0.80 ALDH1A1 (0.56) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL10568375 0.76 KDM4E (0.51) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL11040008 0.76 ALDH1A1 (0.36) KDM4EALDH1A1HPGDHSD17B10ACLY
SCHEMBL10969707 0.75 TP53 (0.41) ALDH1A1ACLYMEN1KMT2AMCL1

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-0070698-B1 HERBICIDAL INDOLE SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-11-13 EP claimed
EP-0070698-A1 Herbicidal indole sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-01-26 EP claimed
US-4836846-A PRE/POST EMERGENCE; WEEDS, GRASSES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-06-06 US disclosed
US-4764610-A Herbicidal indole sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-08-16 US disclosed
EP-0070698-B1 HERBICIDAL INDOLE SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-11-13 EP disclosed
EP-0070698-A1 Herbicidal indole sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1983-01-26 EP disclosed