SCHEMBL7559588

SCHEMBL7559588

CN(C)/C=C(/C(=O)c1ccc(Cl)c(Cl)c1N(C)S(C)(=O)=O)C(=O)C1CC1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
GLA P06280 1/20 0.33
SLC6A4 P31645 2/20 0.32
MAPT P10636 1/20 0.31
CYP11B1 P15538 3/20 0.30
CYP11B2 P19099 2/20 0.30
SLC6A2 P23975 1/20 0.30
PTPN11 Q06124 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL7559590 1.00 POLB (0.34) POLBGLASLC6A4MAPTCYP11B1
SCHEMBL7558431 0.82 POLB (0.32) POLBGLACYP11B1CYP11B2SMN1; SMN2
SCHEMBL7558427 0.82 POLB (0.32) POLBGLACYP11B1CYP11B2SMN1; SMN2
SCHEMBL7559191 0.77 GAA (0.31)
SCHEMBL7559195 0.77 GAA (0.31)
SCHEMBL7554645 0.76 TYK2 (0.41) POLB
SCHEMBL7554648 0.76 TYK2 (0.41) POLB
SCHEMBL8754700 0.76 CYP11B1 (0.34) POLBGLACYP11B1CYP11B2
SCHEMBL7558166 0.76 TYK2 (0.32)
SCHEMBL7556715 0.76 TYK2 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0734380-B1 4-BENZOYLISOXAZOLES AND THEIR USE AS HERBICIDES AVENTIS AGRICULTURE LTD (GB) 2002-07-10 EP disclosed
US-6369270-B1 CHEMICAL INTERMEDIATES RHONE POULENC AGRICULTURE LIMITED (GB) 2002-04-09 US disclosed
US-5998653-A CHEMICAL INTERMEDIATE FOR HERBICIDES RHONE POULENC AGRICULTURE LIMITED (GB) 1999-12-07 US disclosed
US-5658858-A POSTEMERGENCE HERBICIDES RHONE-POULENC ARGRICULTURE LIMITED (GB) 1997-08-19 US disclosed
EP-0734380-A1 4-BENZOYLISOXAZOLES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1996-10-02 EP disclosed
WO-1995016678-A1 4-BENZOYLISOXAZOLES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LIMITED (GB) 1995-06-22 WO disclosed