SCHEMBL6906777

SCHEMBL6906777

CCC(=O)Nc1ccc(C(=O)N(CC)CC)c(S(=O)(=O)NC(=O)Nc2nc(OC)cc(OC)n2)c1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.63
GAA P10253 1/20 0.48
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.39
GLA P06280 1/20 0.39
KMT2A Q03164 1/20 0.36
CYP1A2 P05177 1/20 0.36
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 1/20 0.35
PABPC1 P11940 1/20 0.35
APOBEC3A P31941 1/20 0.35
EIF4H Q15056 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
LMNA P02545 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
SCHEMBL6912806 0.92 CDK1 (0.64) CDK1GAAMAPTTP53GLA
SCHEMBL6107089 0.92 CDK1 (0.75) CDK1GAAMAPTTP53GLA
SCHEMBL6911957 0.92 CDK1 (0.64) CDK1GAAMAPTTP53GLA
SCHEMBL2979899 0.91 CDK1 (0.74) CDK1GAAMAPTTP53GLA
SCHEMBL2979898 0.91 CDK1 (0.74) CDK1GAAMAPTTP53GLA
SCHEMBL6913207 0.89 CDK1 (0.61) CDK1GAAMAPTTP53GLA
SCHEMBL6913737 0.89 CDK1 (0.61) CDK1GAAMAPTTP53GLA
SCHEMBL6905160 0.88 CDK1 (0.81) CDK1GAAMAPTTP53GLA
SCHEMBL27540567 0.88 CDK1 (0.49) CDK1GAAMAPTKMT2APABPC1
SCHEMBL6905978 0.86 CDK1 (0.58) CDK1GAACYP1A2

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
EP-1104239-B1 HERBICIDES WITH ACYLATED AMINOPHENYLSULFONYL UREA BAYER CROPSCIENCE GMBH (DE) 2004-02-18 EP disclosed
EP-1231839-B1 HERBICIDE MEANS WITH ACYLATED AMINO PHENYL SULFONYL CARBAMIDE BAYER CROPSCIENCE GMBH (DE) 2003-05-14 EP disclosed
US-6498126-B1 Herbicide combination with acylated aminophenylsulfonylureas AVENTIS CROPSCIENCE GMBH (DE) 2002-12-24 US disclosed
EP-1231839-A2 HERBICIDE MEANS WITH ACYLATED AMINO PHENYL SULFONYL CARBAMIDE Aventis CropScience GmbH (DE) 2002-08-21 EP disclosed
EP-1104239-A1 HERBICIDES WITH ACYLATED AMINOPHENYLSULFONYL UREA Aventis CropScience GmbH (DE) 2001-06-06 EP disclosed
WO-2001035742-A2 HERBICIDE MEANS WITH ACYLATED AMINO PHENYL SULFONYL CARBAMIDE AVENTIS CROPSCIENCE GMBH (DE) 2001-05-25 WO disclosed
WO-2000008932-A1 HERBICIDES WITH ACYLATED AMINOPHENYLSULFONYL UREA AVENTIS CROPSCIENCE GMBH (DE) 2000-02-24 WO disclosed