SCHEMBL7552802

SCHEMBL7552802

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

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 6/20 0.37
CLCN2 P51788 5/20 0.36
ALDH1A1 P00352 4/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 4/20 0.35
KDM4E B2RXH2 2/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
HSD17B10 Q99714 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
HTT P42858 1/20 0.34
CASP1 P29466 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33

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
SCHEMBL7554657 0.89 CLCN2 (0.35) TP53CYP3A4TSHRCLCN2ALDH1A1
SCHEMBL7552249 0.89 CYP3A4 (0.38) TP53CYP3A4TSHRALDH1A1LMNA
SCHEMBL7552702 0.87 SLC6A2 (0.38) TP53CYP3A4TSHRCLCN2ALDH1A1
SCHEMBL7553749 0.85 TP53 (0.36) TP53CYP3A4TSHRCLCN2ALDH1A1
SCHEMBL7552228 0.85 CYP4F2 (0.43) TP53CYP3A4TSHRALDH1A1LMNA
SCHEMBL7552028 0.85 TP53 (0.36) TP53CYP3A4TSHRCLCN2ALDH1A1
SCHEMBL7556167 0.84 TSHR (0.36) CYP3A4TSHRCLCN2ALDH1A1LMNA
SCHEMBL7557094 0.83 KMT2A (0.41) TP53CYP3A4TSHRALDH1A1LMNA
SCHEMBL7558213 0.82 TSHR (0.35) TP53CYP3A4TSHRALDH1A1LMNA
SCHEMBL7558764 0.81 TSHR (0.40) TP53TSHRCLCN2ALDH1A1SMN1; SMN2

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
US-6369270-B1 CHEMICAL INTERMEDIATES RHONE POULENC AGRICULTURE LIMITED (GB) 2002-04-09 US claimed
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