SCHEMBL7552249

SCHEMBL7552249

CCN(C(=O)OC)c1c(C(=O)Cl)ccc(Cl)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.38
TSHR P16473 5/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 3/20 0.36
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
HTT P42858 1/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
KDM4E B2RXH2 1/20 0.32
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
TAS1R2 Q8TE23 1/20 0.32
MCHR1 Q99705 1/20 0.32
NCEH1 Q6PIU2 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NPC1 O15118 1/20 0.31

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
SCHEMBL7552802 0.89 TP53 (0.38) CYP3A4TSHRALDH1A1LMNATP53
SCHEMBL7552228 0.85 CYP4F2 (0.43) CYP3A4TSHRALDH1A1LMNATP53
SCHEMBL7558213 0.82 TSHR (0.35) CYP3A4TSHRALDH1A1LMNATP53
SCHEMBL7557956 0.80 SLC6A4 (0.35) CYP3A4TSHRALDH1A1LMNATP53
SCHEMBL7554657 0.78 CLCN2 (0.35) CYP3A4TSHRALDH1A1LMNATP53
SCHEMBL7552702 0.76 SLC6A2 (0.38) CYP3A4TSHRALDH1A1LMNATP53
SCHEMBL7552749 0.76 CYP4F2 (0.45) TSHRALDH1A1LMNAHTTSLC6A2
SCHEMBL7553043 0.75 LMNA (0.30) TSHRLMNA
SCHEMBL7558233 0.75 GHSR (0.31) TSHRLMNA
SCHEMBL7553041 0.75 LMNA (0.30) TSHRLMNA

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