SCHEMBL8822162

SCHEMBL8822162

CCOC(=O)Oc1noc(C2CC2)c1C(=O)c1ccc(Cl)c(Cl)c1[S+](C)[O-]

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.30
GPBAR1 Q8TDU6 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
SCHEMBL8494387 0.85 HSP90AA1 (0.34) NR1H4GPBAR1
SCHEMBL8822166 0.84 NR1H4 (0.31) NR1H4GPBAR1
SCHEMBL8822199 0.83 NPC1 (0.34) NR1H4GPBAR1
SCHEMBL8752765 0.81 GPBAR1 (0.32) NR1H4GPBAR1
SCHEMBL8822184 0.79 SMURF2 (0.37) NR1H4GPBAR1
SCHEMBL6966959 0.76 ALOX5 (0.34) NR1H4GPBAR1
SCHEMBL8494727 0.73 HSP90AA1 (0.36) NR1H4
SCHEMBL8492634 0.72 DHODH (0.34)
SCHEMBL8816565 0.71 SLC6A4 (0.39)
SCHEMBL6560302 0.70 CACNA1B (0.36) NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0560482-B1 4-Benzoyl isoxazole derivatives and their use as herbicides RHONE POULENC AGRICULTURE (GB) 1997-08-06 EP claimed