SCHEMBL9517853

SCHEMBL9517853

COc1cc(OC)nc(NC(=O)NS(=O)(=O)c2c(C)cn3ccccc23)n1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.52
MAPT P10636 3/20 0.43
TP53 P04637 1/20 0.43
GLA P06280 1/20 0.43
CDK1 P06493 1/20 0.42
CYP1A2 P05177 1/20 0.40
KMT2A Q03164 2/20 0.39
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.35
USP2 O75604 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
SCHEMBL10616134 0.76 GAA (0.67) GAAMAPTTP53GLACDK1
SCHEMBL9022252 0.76 GAA (0.52) GAAMAPTTP53GLACDK1
SCHEMBL6313355 0.75 GAA (0.57) GAAMAPTTP53GLACDK1
SCHEMBL10670178 0.75 GAA (0.77) GAAMAPTTP53GLACDK1
SCHEMBL10569523 0.75 GAA (0.51) GAAMAPTTP53GLACDK1
SCHEMBL3777329 0.74 GAA (0.61) GAAMAPTTP53GLACDK1
SCHEMBL10984018 0.74 GAA (0.60) GAAMAPTTP53GLACDK1
SCHEMBL10665487 0.73 GAA (0.52) GAAMAPTTP53GLACDK1
SCHEMBL11043791 0.73 GAA (0.49) GAAMAPTTP53GLACDK1
SCHEMBL8827534 0.73 GAA (0.54) GAAMAPTTP53GLACDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0238070-B1 Sulfonylurea compounds, their production and herbicidal use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1993-12-29 EP disclosed
US-5017212-A For rice paddies TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-05-21 US disclosed
EP-0238070-A2 Sulfonylurea compounds, their production and herbicidal use Takeda Chemical Industries, Ltd. (JP) 1987-09-23 EP disclosed