SCHEMBL7550436

SCHEMBL7550436

CC(C)OC(=O)N(C)c1c(C(=O)c2cnoc2C2CC2)ccc(Cl)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.35
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
GPBAR1 Q8TDU6 1/20 0.32
NR1H2 P55055 2/20 0.32
NR1H3 Q13133 2/20 0.32
DHODH Q02127 3/20 0.31
SLC6A4 P31645 1/20 0.31
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
CRACR2A Q9BSW2 1/20 0.30

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
SCHEMBL7553925 0.89 DHODH (0.34) SYKLMNAGPBAR1DHODHSLC6A4
SCHEMBL7550420 0.88 SLC6A2 (0.30) SLC6A4
SCHEMBL7555015 0.86 SLC6A4 (0.35) LMNAHTTGPBAR1DHODHSLC6A4
SCHEMBL7552995 0.85 DHODH (0.34) GPBAR1DHODHSLC6A4KMT2AMEN1
SCHEMBL7552998 0.84 DHODH (0.36) GPBAR1DHODHSLC6A4KMT2AMEN1
SCHEMBL7556608 0.82 DHODH (0.33) DHODHSLC6A4KMT2AMEN1CRACR2A
SCHEMBL8491586 0.80 ALDH1A1 (0.35) LMNADHODHKMT2AMEN1
SCHEMBL7552495 0.80 GAA (0.33) NPSR1GPBAR1DHODHSLC6A4KMT2A
SCHEMBL7550989 0.78 DHODH (0.33) DHODHSLC6A4KMT2AMEN1CRACR2A
SCHEMBL7552560 0.78 SLC6A4 (0.35) LMNAHTTDHODHSLC6A4KMT2A

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5658858-A POSTEMERGENCE HERBICIDES RHONE-POULENC ARGRICULTURE LIMITED (GB) 1997-08-19 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-1995022903-A1 NEW PESTICIDAL METHOD RHONE-POULENC AGROCHIMIE (FR) 1995-08-31 WO disclosed
WO-1995016678-A1 4-BENZOYLISOXAZOLES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LIMITED (GB) 1995-06-22 WO disclosed