SCHEMBL7550378

SCHEMBL7550378

CCOC(=O)c1ccc(C(F)(F)F)cc1N(CC)S(C)(=O)=O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.56
KDM4E B2RXH2 2/20 0.49
ALOX15 P16050 1/20 0.45
GRM5 P41594 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.41
HCRTR1 O43613 1/20 0.40
HCRTR2 O43614 1/20 0.40
ALDH1A1 P00352 2/20 0.40
THRB P10828 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL7557948 0.85 ALDH1A1 (0.50) MAPTKDM4EGRM5HCRTR1HCRTR2
SCHEMBL7557752 0.84 TSHR (0.46) MAPTKDM4EALDH1A1HSD17B10SMN1; SMN2
SCHEMBL7558430 0.81 MCOLN3 (0.51) MAPTALOX15ALDH1A1HSD17B10
SCHEMBL7550423 0.81 LMNA (0.45) MAPTKDM4EALDH1A1HSD17B10SMN1; SMN2
SCHEMBL28495116 0.78 MAPT (0.46) MAPTKDM4EALOX15MRGPRX4ALDH1A1
SCHEMBL4691963 0.77 CA12 (0.50) MAPTKDM4EMRGPRX4NPC1RAB9A
SCHEMBL16647662 0.74 MRGPRX4 (0.51) MAPTKDM4EMRGPRX4THRBNPC1
SCHEMBL1998616 0.74 CES2 (0.60) MAPTKDM4EMRGPRX4NPC1RAB9A
SCHEMBL5943406 0.74 CA12 (0.64) MAPTKDM4EMRGPRX4ALDH1A1NPC1
SCHEMBL28195998 0.74 MRGPRX4 (0.48) MAPTKDM4EMRGPRX4THRBNPC1

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 8 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
CN-1137271-A 4-benzoylisoxazoles and their use as herbicides RHONE POULENC AGRICULTURE (GB) 1996-12-04 CN 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