SCHEMBL7550792

SCHEMBL7550792

CCOc1c(Br)ccc(C(=O)Cl)c1N(C)S(C)(=O)=O

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.37
THRB P10828 1/20 0.37
TSHR P16473 2/20 0.34
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
GAA P10253 1/20 0.34
RECQL P46063 1/20 0.34
HSD17B10 Q99714 1/20 0.32
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.31
HTT P42858 1/20 0.31
TNFRSF1A P19438 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
SCHEMBL7550221 0.86 KMT2A (0.46) KMT2ATSHRMEN1MAPTSMN1; SMN2
SCHEMBL7556623 0.79 KMT2A (0.35) KMT2ATSHRMAPTSMN1; SMN2GAA
SCHEMBL7559191 0.76 GAA (0.31) KMT2AGAA
SCHEMBL7559195 0.76 GAA (0.31) KMT2AGAA
SCHEMBL7557951 0.74 HSD17B10 (0.40) KMT2ATHRBTSHRMEN1MAPT
SCHEMBL7556083 0.74 DHODH (0.31)
SCHEMBL7559544 0.72 MEN1 (0.42) KMT2ATSHRMEN1MAPTSMN1; SMN2
SCHEMBL7843729 0.70 THRB (0.45) KMT2ATHRBTSHRMEN1MAPT
SCHEMBL2200714 0.70 THRB (0.42) KMT2ATHRBTSHRMEN1MAPT
SCHEMBL9403889 0.68 THRB (0.38) KMT2ATHRBTSHRMEN1MAPT

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-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-6114538-A 2-POSITION OF BENZOY RING OF 4-BENZOYLISOXAZOLE DERIVATIVE IS SUBSTITUTED AND PARTICULARLY USED AGAINST MONOCOTYLEDONOUS WEEDS BY POST-EMEREGENECE APPLICATION RHONE POULENC AGRICULTURE LIMITED (GB) 2000-09-05 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