SCHEMBL7690176

SCHEMBL7690176

COC(=O)c1cc(N)c(C(=O)N(C)C)c(S(=O)(=O)NC(=O)Nc2ncc(OC)c(OC)n2)c1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.39
CSNK2A1 P68400 4/20 0.35
ALPL P05186 2/20 0.34
GAA P10253 1/20 0.32
LRRK2 Q5S007 1/20 0.32
PIK3CD O00329 1/20 0.31
TTK P33981 1/20 0.31
ACLY P53396 2/20 0.31

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
SCHEMBL8413618 0.73 EDNRA (0.34) CSNK2A1ALPLLRRK2
SCHEMBL10968069 0.72 CA2 (0.43) GAAACLY
SCHEMBL9199568 0.71 CDK1 (0.39) CDK1ALPLGAA
SCHEMBL11384571 0.70 CDK1 (0.40) CDK1ALPLGAA
SCHEMBL11301926 0.70 KDM4E (0.38) CDK1
SCHEMBL11269372 0.69 KDM4E (0.41) GAA
SCHEMBL11359430 0.69 GAA (0.36) GAALRRK2
SCHEMBL11481800 0.68 CDK1 (0.48) CDK1GAA
SCHEMBL9863318 0.65 LMNA (0.40)
SCHEMBL7062494 0.64 CDK1 (0.64) CDK1GAA

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-6498253-B1 Acylated aminophenylsulfonylureas, processes for their preparation and their use as herbicides and plant growth regulators HOECHST SCHERING AGREVO GMBH (DE) 2002-12-24 US disclosed