SCHEMBL30700263

SCHEMBL30700263

O=C(N1CCC(c2nnc[nH]2)C1)N1CC2(CC(Oc3cncc(C(F)(F)F)c3)C2)C1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ABHD6 Q9BV23 9/20 0.42
▸ MGLL Q99685 3/20 0.39
▸ PIK3CD O00329 2/20 0.33
▸ PIK3CA P42336 2/20 0.33
▸ MDM2 Q00987 2/20 0.31
▸ LOXL2 Q9Y4K0 2/20 0.31
▸ ACACB O00763 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
SCHEMBL30700413 0.88 ABHD6 (0.39) ABHD6PIK3CDPIK3CA
SCHEMBL30700303 0.79 LPL (0.35) MGLL
SCHEMBL30700053 0.77 MGLL (0.40) MGLLPIK3CDPIK3CA
SCHEMBL30699868 0.76 MGLL (0.34) MGLL
SCHEMBL30700375 0.76 LOXL2 (0.36) ABHD6MDM2LOXL2
SCHEMBL30700320 0.76 MGLL (0.40) MGLL
SCHEMBL30700414 0.76 ENPP2 (0.35) MGLL
SCHEMBL30700261 0.76 ENPP2 (0.35) MGLL
SCHEMBL30700195 0.76 ENPP2 (0.35) MGLL
SCHEMBL25324159 0.76 ABHD6 (0.44) ABHD6MGLL

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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