SCHEMBL30700368

SCHEMBL30700368

O=C(N1CC(OCc2cnc(C(F)(F)F)nc2)C1)N1CCC(c2nnc[nH]2)C1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 7/20 0.40
▸ FAAH O00519 1/20 0.36
▸ PIK3CD O00329 2/20 0.34
▸ PIK3R1 P27986 1/20 0.32
▸ TIPARP Q7Z3E1 2/20 0.31
▸ HPGDS O60760 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
SCHEMBL30700127 0.89 MGLL (0.42) MGLLFAAHPIK3CDPIK3R1
SCHEMBL30700053 0.85 MGLL (0.40) MGLLFAAHPIK3CD
SCHEMBL30700110 0.83 ENPP2 (0.39) MGLLPIK3CDPIK3R1
SCHEMBL30700437 0.81 MGLL (0.40) MGLLFAAHPIK3CDPIK3R1
SCHEMBL30700845 0.79 TRPC6 (0.39) MGLL
SCHEMBL30700301 0.79 MGLL (0.44) MGLLFAAH
SCHEMBL30700259 0.77 ENPP2 (0.39) PIK3CDPIK3R1
SCHEMBL27291240 0.75 MGLL (0.36) MGLL
SCHEMBL30700018 0.75 ENPP2 (0.39) MGLLPIK3CDPIK3R1
SCHEMBL30700337 0.75 SCN9A (0.33) FAAHPIK3CD

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 3 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
WO-2023247670-A1 NEW HETEROCYCLIC-CARBONYL-CYCLIC COMPOUNDS AS MAGL INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2023-12-28 — — WO claimed
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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