SCHEMBL8747792

SCHEMBL8747792

CCOC(=O)c1noc(C2CC2)c1C(=O)c1ccccc1CN(C)S(C)(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.36
HCRTR2 O43614 3/20 0.35
DRD4 P21917 1/20 0.35
TDP2 O95551 2/20 0.35
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
ALDH1A1 P00352 3/20 0.34
TSHR P16473 2/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 2/20 0.34
GAA P10253 2/20 0.34
APAF1 O14727 1/20 0.34
MITF O75030 1/20 0.34
RECQL P46063 1/20 0.34
HTT P42858 1/20 0.33
FTO Q9C0B1 1/20 0.33
KDM4E B2RXH2 2/20 0.33
HPGD P15428 2/20 0.33
HCRTR1 O43613 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
SCHEMBL27472298 0.88 NR1H4 (0.40) NR1H4KMT2AMEN1SMN1; SMN2LMNA
SCHEMBL9113480 0.87 HCRTR2 (0.37) HCRTR2TDP2SMN1; SMN2ALDH1A1TSHR
SCHEMBL9115275 0.85 TSHR (0.36) HCRTR2TDP2KMT2ASMN1; SMN2ALDH1A1
SCHEMBL6292089 0.84 TSHR (0.38) HCRTR2TDP2SMN1; SMN2ALDH1A1TSHR
SCHEMBL8890411 0.84 TSHR (0.34) HCRTR2DRD4TDP2SMN1; SMN2ALDH1A1
SCHEMBL8493474 0.83 TSHR (0.37) HCRTR2TDP2SMN1; SMN2ALDH1A1TSHR
SCHEMBL9116296 0.82 TSHR (0.36) HCRTR2TDP2KMT2AMEN1ALDH1A1
SCHEMBL8890586 0.82 ALDH1A1 (0.37) HCRTR2DRD4SMN1; SMN2ALDH1A1TSHR
SCHEMBL8747816 0.81 ELANE (0.42) HCRTR2TDP2KMT2AMEN1SMN1; SMN2
SCHEMBL9115212 0.80 TSHR (0.35) HCRTR2TDP2ALDH1A1TSHRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0759911-A1 4-BENZOYLISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LTD. (GB) 1997-03-05 EP claimed
WO-1995031446-A1 4-BENZOYLISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LTD. (GB) 1995-11-23 WO claimed
EP-0759911-A1 4-BENZOYLISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LTD. (GB) 1997-03-05 EP disclosed
WO-1995031446-A1 4-BENZOYLISOXAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE LTD. (GB) 1995-11-23 WO disclosed