SCHEMBL253247

SCHEMBL253247

CS(=O)(=O)n1nc(C(=O)O)c(=O)n(-c2ccccc2C#N)c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
ALOX15 P16050 2/20 0.41
HSD17B10 Q99714 2/20 0.41
MAPT P10636 2/20 0.39
CXCR3 P49682 1/20 0.35
NOTUM Q6P988 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HIF1A Q16665 1/20 0.34
KMT2A Q03164 1/20 0.33
MAT2A P31153 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
DRD2 P14416 1/20 0.32
DRD4 P21917 1/20 0.32
MAPK1 P28482 1/20 0.32
DHODH Q02127 1/20 0.32
ERCC5 P28715 1/20 0.32
FEN1 P39748 1/20 0.32

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
SCHEMBL246360 0.84 KDM4E (0.45) KDM4EALOX15HSD17B10MAPTCXCR3
SCHEMBL254436 0.80 GSK3A (0.41) KDM4EMAPTKMT2AALDH1A1HPGD
SCHEMBL254120 0.70 GSK3A (0.39) KDM4EHIF1AKMT2AALDH1A1HTT
SCHEMBL20503072 0.69 MAPT (0.52) KDM4EHSD17B10MAPTSMN1; SMN2KMT2A
SCHEMBL17427353 0.65 KDM4E (0.49) KDM4EALOX15HSD17B10MAPTNOTUM
SCHEMBL17427352 0.65 NOTUM (0.44) KDM4EALOX15HSD17B10NOTUMSMN1; SMN2
SCHEMBL20604178 0.64 MAPT (0.80) KDM4EALOX15HSD17B10MAPTNOTUM
SCHEMBL30619347 0.63 ALDH1A1 (0.62) KDM4EALOX15HSD17B10MAPTSMN1; SMN2
SCHEMBL15557582 0.63 HTR3A (0.54) HIF1ANPSR1
SCHEMBL248654 0.61 GSK3A (0.47) KDM4EMAPTSMN1; SMN2KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2542538-A1 6-ACYL-1,2,4-TRIAZINE-3,5-DIONE DERIVATIVE AND HERBICIDES Kumiai Chemical Industry Co., Ltd. (JP) 2013-01-09 EP disclosed
WO-2012002096-A1 6-ACYL-1,2,4-TRIAZINE-3,5-DIONE DERIVATIVE AND HERBICIDES KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2012-01-05 WO disclosed