SCHEMBL14647403

SCHEMBL14647403

CC(C)(C)S(=O)(=O)C[C@H]1CCOC1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.34
CNR1 P21554 2/20 0.34
AOC2 O75106 2/20 0.33
MAOA P21397 2/20 0.33
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
TYK2 P29597 1/20 0.32
JAK3 P52333 1/20 0.32
AKT1 P31749 1/20 0.31
PIK3CA P42336 1/20 0.31
MTOR P42345 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
SCHEMBL10147821 0.88 CNR2 (0.40) CNR2CNR1
SCHEMBL13392940 0.84 CNR2 (0.32) CNR2CNR1AOC2MAOAJAK2
SCHEMBL13448691 0.84 CNR2 (0.32) CNR2CNR1AOC2MAOAJAK2
SCHEMBL10171246 0.82 CNR2 (0.34) CNR2CNR1AOC2MAOAJAK2
SCHEMBL10171252 0.82 CNR2 (0.34) CNR2CNR1AOC2MAOAJAK2
SCHEMBL13392854 0.81
SCHEMBL13391412 0.81
SCHEMBL10171815 0.81 CNR2 (0.40) CNR2CNR1AOC2MAOA
SCHEMBL10171801 0.81 CNR2 (0.40) CNR2CNR1AOC2MAOA
SCHEMBL13392840 0.80 CNR2 (0.40) CNR2CNR1AOC2MAOAJAK2

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-2342200-B1 Compounds which selectively modulate the cb2 receptor BOEHRINGER INGELHEIM INT (DE) 2013-01-23 EP disclosed