SCHEMBL8613281

SCHEMBL8613281

COc1cc(OC)nc(NC(=O)NS(=O)(=O)c2ccccc2C(O)CF)n1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.55
CDK1 P06493 1/20 0.47
MAPT P10636 2/20 0.46
TP53 P04637 1/20 0.46
GLA P06280 1/20 0.46
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP1A2 P05177 1/20 0.40

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
SCHEMBL9127057 0.94 TSHR (0.50) GAACDK1MAPTTP53GLA
SCHEMBL9243511 0.93 GAA (0.54) GAACDK1MAPTTP53GLA
SCHEMBL9127116 0.90 GAA (0.53) GAACDK1MAPTTP53GLA
SCHEMBL11130838 0.87 GAA (0.57) GAACDK1MAPTTP53GLA
SCHEMBL9126935 0.86 GAA (0.56) GAACDK1MAPTTP53GLA
SCHEMBL8615221 0.86 GAA (0.52) GAACDK1MAPTTP53GLA
SCHEMBL9125715 0.86 LMNA (0.46) GAAMAPTKDM4ENPC1ALDH1A1
SCHEMBL7456515 0.86 GAA (0.53) GAACDK1MAPTTP53GLA
SCHEMBL8098891 0.85 GAA (0.55) GAACDK1MAPTTP53GLA
SCHEMBL7806542 0.85 GAA (0.53) GAACDK1MAPTTP53GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5461025-A Herbicides KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1995-10-24 US claimed
EP-0575378-A1 BENZENESULFONYLUREA DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1993-12-29 EP claimed
WO-1992015568-A1 BENZENESULFONYLUREA DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1992-09-17 WO claimed
US-5736628-A HERBICIDE KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1998-04-07 US disclosed
US-5461025-A Herbicides KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1995-10-24 US disclosed
EP-0575378-A1 BENZENESULFONYLUREA DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1993-12-29 EP disclosed
WO-1992015568-A1 BENZENESULFONYLUREA DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1992-09-17 WO disclosed