Isoproturon

Isoproturon

SCHEMBL11209065

CC(C)[C@H](N)C(=O)O.CC(C)c1ccc(NC(=O)N(C)C)cc1

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.51
KIF11 P52732 1/20 0.48
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA9 Q16790 2/20 0.47
APEX1 P27695 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
SLC7A5 Q01650 1/20 0.43
MTOR P42345 1/20 0.42
HPGD P15428 1/20 0.42

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
Isoproturon SCHEMBL8518619 0.86 TSHR (0.67) TSHRKIF11CA12CA1CA2
Isoproturon SCHEMBL62200 0.86 TSHR (0.67) TSHRKIF11CA12CA1CA2
Isoproturon SCHEMBL2232082 0.85 TSHR (0.61) TSHRKIF11CA12CA1CA2
Isoproturon SCHEMBL28224193 0.85 TSHR (0.65) TSHRKIF11CA12CA1CA2
Dcmu SCHEMBL3316481 0.82 APEX1 (0.71) TSHRCA2CA9APEX1SMN1; SMN2
SCHEMBL11573947 0.80 TSHR (0.54) TSHRCA12CA1CA2CA9
Isoproturon SCHEMBL28241261 0.78 NPY5R (0.60) TSHR
Isoproturon SCHEMBL29899137 0.77 TSHR (0.54) TSHRKIF11CA12CA1CA2
Isoproturon SCHEMBL28366631 0.77 TSHR (0.51) TSHRALDH1A1MTORHPGD
Isoproturon SCHEMBL27446851 0.76 TSHR (0.50) TSHRKIF11CA12CA1CA2

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
EP-0081870-A1 A composition for selective control of weeds and method for controlling weeds in a crop area SIEGFRIED AKTIENGESELLSCHAFT (CH) 1983-06-22 EP disclosed