SCHEMBL8747759

SCHEMBL8747759

CN(Cc1c(C(=O)c2cnoc2C2CC2)ccc(Cl)c1F)S(C)(=O)=O

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 9/20 0.33
DHODH Q02127 2/20 0.32
GRM5 P41594 1/20 0.32
HPGD P15428 1/20 0.32
KAT5 Q92993 1/20 0.31
CRHR1 P34998 1/20 0.31
P2RX7 Q99572 1/20 0.31
TACR3 P29371 1/20 0.31
GAA P10253 1/20 0.31
PDE2A O00408 1/20 0.31

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
SCHEMBL8748147 0.90 DHODH (0.33) NR1H4DHODHTACR3PDE2A
SCHEMBL8747824 0.86 NR1H4 (0.31) NR1H4DHODHGAAPDE2A
SCHEMBL8747751 0.85 NR1H4 (0.31) NR1H4GAAPDE2A
SCHEMBL9117324 0.84 DHODH (0.36) NR1H4DHODHHPGDCRHR1P2RX7
SCHEMBL27456386 0.83 GAA (0.33) NR1H4GAAPDE2A
SCHEMBL8748151 0.83 F2 (0.34) DHODHGAAPDE2A
SCHEMBL8747750 0.83 DPP4 (0.35) DHODHTACR3PDE2A
SCHEMBL7575360 0.82 DHODH (0.34) NR1H4DHODHHPGDCRHR1P2RX7
SCHEMBL7554901 0.82 GRM5 (0.35) DHODHGRM5HPGDGAA
SCHEMBL8492875 0.81 DHODH (0.35) DHODHHPGDP2RX7PDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1148385-A 4-benzoylisoxazole derivatives and their use as herbicides RHONE POULENC AGRICULTURE (GB) 1997-04-23 CN claimed
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