SCHEMBL7558320

SCHEMBL7558320

CCO/C=C(\C(=O)c1ccc(Cl)c(Cl)c1NC(=O)OCC)C(=O)C1CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.39
ALDH1A1 P00352 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 2/20 0.36
TSHR P16473 3/20 0.35
KDM4E B2RXH2 3/20 0.35
GLA P06280 1/20 0.35
POLB P06746 1/20 0.35
RECQL P46063 1/20 0.35
RAB9A P51151 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
MAPT P10636 2/20 0.33
GAA P10253 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPK13 O15264 1/20 0.32
MAPK12 P53778 1/20 0.32
MAPK11 Q15759 1/20 0.32

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
SCHEMBL7557031 0.93 NLRP3 (0.35) NLRP3ALDH1A1SMN1; SMN2LMNATSHR
SCHEMBL7557079 0.89 KMT2A (0.33) NLRP3SMN1; SMN2LMNAKMT2A
SCHEMBL8488252 0.84 SLC6A4 (0.35) ALDH1A1SMN1; SMN2LMNATSHRKDM4E
SCHEMBL8488251 0.84 SLC6A4 (0.35) ALDH1A1SMN1; SMN2LMNATSHRKDM4E
SCHEMBL7557083 0.79 SLC6A4 (0.35) ALDH1A1SMN1; SMN2LMNATSHRKDM4E
SCHEMBL7550797 0.78 SLC6A4 (0.35) ALDH1A1SMN1; SMN2LMNATSHRKDM4E
SCHEMBL7550800 0.78 SLC6A4 (0.35) ALDH1A1SMN1; SMN2LMNATSHRKDM4E
SCHEMBL7558324 0.77 SLC6A4 (0.33) SLC6A2SLC6A4
SCHEMBL7550747 0.76 SLC6A2 (0.33) SLC6A2SLC6A4
SCHEMBL7550745 0.76 SLC6A2 (0.33) SLC6A2SLC6A4

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-5998653-A CHEMICAL INTERMEDIATE FOR HERBICIDES RHONE POULENC AGRICULTURE LIMITED (GB) 1999-12-07 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