SCHEMBL7552079

SCHEMBL7552079

CCN(C(=O)OC)c1c(C(=O)OC)ccc(Br)c1OC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
USP2 O75604 2/20 0.36
ALOX15 P16050 2/20 0.36
KDM4E B2RXH2 8/20 0.35
POLB P06746 3/20 0.35
LMNA P02545 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 5/20 0.34
GAA P10253 3/20 0.34
GLA P06280 2/20 0.34
HPGD P15428 3/20 0.33
HSD17B10 Q99714 3/20 0.33
NPSR1 Q6W5P4 3/20 0.33
HTR1A P08908 1/20 0.33
ADRA2A P08913 1/20 0.33
CYP2D6 P10635 1/20 0.33
DRD2 P14416 1/20 0.33
ADRA2C P18825 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
SCHEMBL7557946 0.90 TDP1 (0.38) MAPTMEN1KMT2AUSP2ALOX15
SCHEMBL7557884 0.89 HSD17B10 (0.40) MAPTMEN1KMT2AUSP2ALOX15
SCHEMBL7555032 0.81 DRD3 (0.35) MAPTMEN1KMT2APOLBHTR1A
SCHEMBL7557820 0.79 HSD17B10 (0.40) MAPTMEN1KMT2ALMNAL3MBTL1
SCHEMBL7550405 0.74 STAT1 (0.33) MEN1KMT2AHTR1AADRA2ACYP2D6
SCHEMBL7558222 0.74 MEN1 (0.31) MEN1KMT2AHTR1AADRA2ACYP2D6
SCHEMBL7558216 0.74 MEN1 (0.31) MEN1KMT2AHTR1AADRA2ACYP2D6
SCHEMBL7555053 0.74 HTT (0.35) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL31172701 0.74 KDM4E (0.46) MAPTKMT2AUSP2KDM4EPOLB
SCHEMBL31739140 0.74 KDM4E (0.41) MAPTMEN1KMT2AUSP2ALOX15

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