SCHEMBL30700206

SCHEMBL30700206

O=C(N1CCC(c2nnc[nH]2)C1)N1CC2(CCC(Oc3ccnc(C(F)(F)F)n3)CC2)C1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MALT1 Q9UDY8 2/20 0.35
▸ MDM2 Q00987 7/20 0.31
▸ MAP3K12 Q12852 2/20 0.31
▸ AXL P30530 1/20 0.31
▸ TYRO3 Q06418 1/20 0.31
▸ MERTK Q12866 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ DPP4 P27487 1/20 0.31
▸ DPP8 Q6V1X1 1/20 0.31
▸ DPP9 Q86TI2 1/20 0.31
▸ DPP7 Q9UHL4 1/20 0.31
▸ ACACB O00763 1/20 0.31
▸ LOXL2 Q9Y4K0 2/20 0.31
▸ HSD11B1 P28845 1/20 0.30
▸ GPR119 Q8TDV5 1/20 0.30
▸ CGAS Q8N884 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
SCHEMBL30699966 0.85 LOXL2 (0.33) LOXL2GPR119
SCHEMBL30700784 0.84 GPR119 (0.37) MDM2LOXL2GPR119
SCHEMBL30700375 0.83 LOXL2 (0.36) MDM2LOXL2GPR119
SCHEMBL30700321 0.81 MALT1 (0.36) MALT1AXLTYRO3MERTKCYP2D6
SCHEMBL25326125 0.80 MALT1 (0.38) MALT1AXLTYRO3MERTKCYP2D6
SCHEMBL30553211 0.80 MALT1 (0.38) MALT1AXLTYRO3MERTKCYP2D6
SCHEMBL30700414 0.79 ENPP2 (0.35) —
SCHEMBL30700261 0.79 ENPP2 (0.35) —
SCHEMBL30700195 0.79 ENPP2 (0.35) —
SCHEMBL30700117 0.75 DPP4 (0.40) MAP3K12CYP2D6DPP4HSD11B1

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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