SCHEMBL30700114

SCHEMBL30700114

NS(=O)(=O)C1CCN(C(=O)N2CC3(CCN(Cc4ccc(C(F)(F)F)cc4F)CC3)C2)C1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 3/20 0.41
▸ ATXN2 Q99700 3/20 0.41
▸ MGLL Q99685 3/20 0.40
▸ FAAH O00519 1/20 0.40
▸ GPR183 P32249 6/20 0.39
▸ CYP3A4 P08684 2/20 0.37
▸ CYP2D6 P10635 2/20 0.37
▸ TSHR P16473 2/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ GPR119 Q8TDV5 1/20 0.37
▸ ABHD6 Q9BV23 1/20 0.37
▸ USP2 O75604 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CA2 P00918 1/20 0.37

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
SCHEMBL30700371 0.86 ENPP2 (0.43) ENPP2ATXN2MGLLFAAHGPR183
SCHEMBL30700172 0.86 ENPP2 (0.43) ENPP2ATXN2MGLLFAAHGPR183
SCHEMBL30699993 0.83 ENPP2 (0.42) ENPP2ATXN2MGLLFAAHCYP3A4
SCHEMBL25253780 0.80 FAAH (0.47) ENPP2ATXN2MGLLFAAHGPR183
SCHEMBL30700370 0.79 FAAH (0.44) ENPP2ATXN2MGLLFAAHGPR183
SCHEMBL30700512 0.79 FAAH (0.44) ENPP2ATXN2MGLLFAAHGPR183
SCHEMBL31307999 0.79 ENPP2 (0.41) ENPP2ATXN2MGLLFAAHGPR183
SCHEMBL31308016 0.79 ENPP2 (0.41) ENPP2ATXN2MGLLFAAHGPR183
SCHEMBL30700573 0.79 ENPP2 (0.41) ENPP2ATXN2MGLLFAAHGPR183
SCHEMBL30700038 0.79 MGLL (0.44) ENPP2ATXN2MGLLCA2

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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