SCHEMBL7550819

SCHEMBL7550819

CCOC(=O)c1ccc(SC)c(F)c1N(CC)S(C)(=O)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.39
ALDH1A1 P00352 4/20 0.39
LMNA P02545 3/20 0.39
NPSR1 Q6W5P4 2/20 0.39
HSD17B10 Q99714 3/20 0.37
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA12 O43570 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
KDM4E B2RXH2 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TP53 P04637 1/20 0.34
HTT P42858 1/20 0.34
RECQL P46063 2/20 0.34
GAA P10253 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL7553893 0.86 CA1 (0.41) TSHRALDH1A1LMNANPSR1HSD17B10
SCHEMBL7552041 0.85 LMNA (0.38) TSHRALDH1A1LMNANPSR1HSD17B10
SCHEMBL7557970 0.85 TSHR (0.41) TSHRALDH1A1LMNANPSR1HSD17B10
SCHEMBL7557028 0.83 MAPT (0.43) TSHRALDH1A1LMNANPSR1HSD17B10
SCHEMBL7554583 0.78 ALDH1A1 (0.40) TSHRALDH1A1LMNAHSD17B10CA1
SCHEMBL7556110 0.75 TSHR (0.41) TSHRALDH1A1LMNANPSR1HSD17B10
SCHEMBL7557752 0.73 TSHR (0.46) TSHRALDH1A1LMNANPSR1HSD17B10
SCHEMBL7550506 0.73 TSHR (0.47) TSHRALDH1A1LMNAHSD17B10CA1
SCHEMBL7559544 0.72 MEN1 (0.42) TSHRALDH1A1LMNANPSR1HSD17B10
SCHEMBL7556733 0.72 MEN1 (0.43) TSHRALDH1A1LMNANPSR1HSD17B10

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