SCHEMBL7952829

SCHEMBL7952829

CC(C)(C)NS(=O)(=O)c1cc(NN)ccc1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.46
KDM4E B2RXH2 3/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
POLB P06746 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 6/20 0.40
HSD17B10 Q99714 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
PTPN5 P54829 1/20 0.39
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
MMP8 P22894 1/20 0.37
MMP13 P45452 1/20 0.37
NSD2 O96028 2/20 0.37
CA12 O43570 2/20 0.37
CA9 Q16790 2/20 0.37

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
SCHEMBL7953153 0.86 CA1 (0.43) MAPTKDM4ENPC1ALDH1A1HSD17B10
SCHEMBL6153148 0.80 NPSR1 (0.44) MAPTKDM4EPOLBTDP1HSD17B10
SCHEMBL11595770 0.79 HSD17B10 (0.49) KDM4EALDH1A1HSD17B10SMN1; SMN2CA1
SCHEMBL8537785 0.75 ALDH1A1 (0.40) MAPTKDM4ENPC1RAB9AALDH1A1
SCHEMBL9786904 0.74 CA1 (0.66) ALDH1A1SMN1; SMN2CA1CA2MMP1
SCHEMBL6152020 0.74 ACLY (0.43) MAPTKDM4ENPC1RAB9APOLB
SCHEMBL2476297 0.74 ACLY (0.45) CA1CA2MMP1MMP2MMP9
SCHEMBL9201412 0.72 CDK1 (0.43) MAPTKDM4ENPC1ALDH1A1HSD17B10
SCHEMBL8661923 0.72 CDK1 (0.43) MAPTKDM4ENPC1POLBALDH1A1
SCHEMBL12998745 0.71 TDP1 (0.69) MAPTKDM4ENPC1RAB9APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6265348-B1 Alkylidenehydrazinophenylsulfonylureas, processes for their preparation and their use as herbicides and plant growth regulators HOECHST SCHERING AGREVO GMBH (DE) 2001-07-24 US disclosed