SCHEMBL30700009

SCHEMBL30700009

O=C(N1CC(OCc2ccc(C(F)(F)F)cc2F)C1)N1CC[C@@H](c2ncn[nH]2)C1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 6/20 0.46
▸ FAAH O00519 1/20 0.40
▸ LPL P06858 2/20 0.37
▸ LIPC P11150 2/20 0.37
▸ LIPG Q9Y5X9 2/20 0.37
▸ ENPP2 Q13822 3/20 0.37
▸ ATXN2 Q99700 3/20 0.37
▸ PIK3CA P42336 1/20 0.37
▸ PRKAA2 P54646 1/20 0.37
▸ PIM1 P11309 1/20 0.36
▸ GLP1R P43220 1/20 0.35
▸ PDE2A O00408 1/20 0.35

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
SCHEMBL27289691 1.00 MGLL (0.46) MGLLFAAHLPLLIPCLIPG
SCHEMBL30700176 1.00 MGLL (0.46) MGLLFAAHLPLLIPCLIPG
SCHEMBL30700174 1.00 MGLL (0.46) MGLLFAAHLPLLIPCLIPG
SCHEMBL27289695 1.00 MGLL (0.46) MGLLFAAHLPLLIPCLIPG
SCHEMBL30700147 1.00 MGLL (0.46) MGLLFAAHLPLLIPCLIPG
SCHEMBL30700335 0.95 MGLL (0.44) MGLLFAAHLPLLIPCLIPG
SCHEMBL27290308 0.92 MGLL (0.43) MGLLFAAHLPLLIPCLIPG
SCHEMBL30700152 0.92 MGLL (0.43) MGLLFAAHLPLLIPCLIPG
SCHEMBL27290848 0.91 MGLL (0.47) MGLLFAAHPIM1
SCHEMBL30699982 0.86 MGLL (0.44) MGLLFAAHLPLLIPCLIPG

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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