SCHEMBL30700138

SCHEMBL30700138

O=C(N1CC[C@H](c2ncn[nH]2)C1)N1CC2(CC[C@H](Oc3cnc(C(F)(F)F)cn3)C2)C1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 6/20 0.36
▸ ABHD6 Q9BV23 2/20 0.34
▸ LOXL2 Q9Y4K0 2/20 0.34
▸ MGLL Q99685 3/20 0.33
▸ HCRTR1 O43613 7/20 0.33
▸ PIK3CD O00329 1/20 0.32
▸ PIK3R1 P27986 1/20 0.32
▸ FAAH O00519 1/20 0.32
▸ HCRTR2 O43614 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
SCHEMBL30700757 0.83 MGLL (0.38) MGLL
SCHEMBL30700419 0.83 MGLL (0.38) MGLL
SCHEMBL30699974 0.82 LIPE (0.42) ABHD6MGLLPIK3CDPIK3R1
SCHEMBL30700376 0.81 ABHD6 (0.39) GPR119ABHD6LOXL2MGLLHCRTR1
SCHEMBL30700784 0.81 GPR119 (0.37) GPR119LOXL2HCRTR1HCRTR2
SCHEMBL30700334 0.81 MGLL (0.36) MGLLPIK3CDPIK3R1
SCHEMBL30700187 0.80 MGLL (0.43) MGLLPIK3CDPIK3R1
SCHEMBL25324569 0.80 ABHD6 (0.37) GPR119ABHD6LOXL2MGLLHCRTR1
SCHEMBL30553161 0.80 ABHD6 (0.37) GPR119ABHD6LOXL2MGLLHCRTR1
SCHEMBL30700429 0.79 LIPE (0.35) ABHD6

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
Send feedback