SCHEMBL30700122

SCHEMBL30700122

CS(=O)(=O)c1cc(OC(F)(F)F)ccc1OCC1CCN(C(=O)N2CC[C@H](c3nnc[nH]3)C2)CC1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SCN7A Q01118 1/20 0.38
▸ SCN5A Q14524 1/20 0.38
▸ MGLL Q99685 2/20 0.38
▸ SCN8A Q9UQD0 1/20 0.38
▸ SCN10A Q9Y5Y9 1/20 0.38
▸ GPR119 Q8TDV5 2/20 0.35
▸ SLC6A9 P48067 1/20 0.34
▸ MAPK7 Q13164 2/20 0.34
▸ RBP4 P02753 1/20 0.34
▸ ABL1 P00519 3/20 0.33
▸ CACNA1B Q00975 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
SCHEMBL25324392 0.80 SCN7A (0.39) SCN7ASCN5AMGLLSCN8ASCN10A
SCHEMBL30700086 0.77 MGLL (0.38) MGLLGPR119RBP4
SCHEMBL30700145 0.77 CHRNA7 (0.43) MGLLSCN10AGPR119
SCHEMBL30700626 0.76 MGLL (0.49) SCN7ASCN5AMGLLSCN8ASCN10A
SCHEMBL25325227 0.74 MGLL (0.36) SCN7ASCN5AMGLLSCN8ASCN10A
SCHEMBL30700302 0.74 MGLL (0.40) MGLLGPR119RBP4
SCHEMBL30700707 0.71 GPR119 (0.40) MGLLGPR119
SCHEMBL30700736 0.71 HCRTR2 (0.35) GPR119MAPK7
SCHEMBL30699973 0.70 SCN9A (0.41) SCN7AMGLLSCN10AMAPK7
SCHEMBL27291566 0.70 SCN9A (0.41) SCN7AMGLLSCN10AMAPK7

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
EP-4543870-A1 NEW HETEROCYCLIC-CARBONYL-CYCLIC COMPOUNDS AS MAGL INHIBITORS F. Hoffmann-La Roche AG (CH) 2025-04-30 — — EP claimed
CN-119301113-A Novel heterocyclic carbonyl cyclic compounds as MAGL inhibitors 豪夫迈·罗氏有限公司 2025-01-10 — — CN claimed
WO-2023247670-A1 NEW HETEROCYCLIC-CARBONYL-CYCLIC COMPOUNDS AS MAGL INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2023-12-28 — — WO claimed
CN-119301113-A Novel heterocyclic carbonyl cyclic compounds as MAGL inhibitors 豪夫迈·罗氏有限公司 2025-01-10 — — CN disclosed
WO-2023247670-A1 NEW HETEROCYCLIC-CARBONYL-CYCLIC COMPOUNDS AS MAGL INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2023-12-28 — — WO disclosed
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