SCHEMBL9037756

SCHEMBL9037756

COc1nc(C)nc(NC(=O)NS(=O)(=O)c2c(Cl)n(C)ccc2=O)n1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.37
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
KMT2A Q03164 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
ALOX15 P16050 1/20 0.33
MAPT P10636 1/20 0.32
CDK1 P06493 1/20 0.31
TP53 P04637 1/20 0.31
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30

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
SCHEMBL11637514 0.80 ALDH1A1 (0.47) GAAALDH1A1KDM4ENPC1KMT2A
SCHEMBL9021912 0.78 GAA (0.38) GAAALDH1A1KDM4ENPC1KMT2A
SCHEMBL9074375 0.78 GAA (0.38) GAAALDH1A1KDM4ENPC1KMT2A
SCHEMBL8530141 0.76 ALDH1A1 (0.40) GAAALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL10738157 0.76 KDM4E (0.38) GAAALDH1A1KDM4ENPC1MAPT
SCHEMBL10909928 0.75 ALDH1A1 (0.45) GAAALDH1A1KDM4ENPC1KMT2A
SCHEMBL11043115 0.75 ALDH1A1 (0.43) GAAALDH1A1KDM4ENPC1KMT2A
Chlorsulfuron SCHEMBL7902297 0.75 ALDH1A1 (0.61) GAAALDH1A1KDM4ENPC1KMT2A
Chlorsulfuron SCHEMBL54874 0.75 ALDH1A1 (0.61) GAAALDH1A1KDM4ENPC1KMT2A
SCHEMBL11123282 0.75 GAA (0.36) GAAALDH1A1USP2

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
EP-0733629-A1 Pyridonesulfonylurea compounds, process for their production and herbicides containing them ISHIHARA SANGYO KAISHA, LTD. (JP) 1996-09-25 EP disclosed