SCHEMBL27576751

SCHEMBL27576751

COc1ccnc(NC(=O)NS(=O)(=O)c2cc(CNS(C)(=O)=O)ccc2C(=O)O)n1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.43
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.37
SYK P43405 4/20 0.36
KDM4E B2RXH2 1/20 0.34
ASPH Q12797 1/20 0.34
KDM8 Q8N371 1/20 0.34
KDR P35968 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL13370005 0.91 CDK1 (0.52) CDK1GAAKMT2AMAPT
SCHEMBL121017 0.91 CDK1 (0.52) CDK1GAAKMT2AMAPT
SCHEMBL21585569 0.90 CDK1 (0.51) CDK1GAAKMT2AMAPT
SCHEMBL6443045 0.87 CDK1 (0.49) CDK1GAAKMT2AMAPT
Metam SCHEMBL2583507 0.84 CDK1 (0.46) CDK1GAAKMT2AMAPT
SCHEMBL19463933 0.84 CDK1 (0.50) CDK1GAAKMT2AKDM4EMAPT
SCHEMBL15273260 0.84 CDK1 (0.46) CDK1GAAKMT2AKDM4EMAPT
SCHEMBL19283719 0.83 CDK1 (0.52) CDK1GAAKMT2AMAPT
SCHEMBL116828 0.83 CDK1 (0.52) CDK1GAAKMT2AMAPT
SCHEMBL2108886 0.82 CDK1 (0.51) CDK1GAAKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1407854-A N-aryi-uracile-based herbicides BAYER AG (DE) 2003-04-02 CN claimed
CN-1509141-A Herbicides based on substituted aryl ketones �ݶ�ũ�����ѧ�ɷݹ�˾ 2004-06-30 CN disclosed