SCHEMBL30700321

SCHEMBL30700321

NC(=O)[C@H]1CCN(C(=O)N2CC3(CCC(Oc4ccnc(C(F)(F)F)n4)CC3)C2)C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MALT1 Q9UDY8 2/20 0.36
▸ HSD11B1 P28845 3/20 0.36
▸ GAA P10253 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ ACACB O00763 4/20 0.34
▸ LOXL2 Q9Y4K0 2/20 0.33
▸ AXL P30530 2/20 0.33
▸ TYRO3 Q06418 2/20 0.33
▸ PDK2 Q15119 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ DPP4 P27487 1/20 0.33
▸ DPP8 Q6V1X1 1/20 0.33
▸ DPP9 Q86TI2 1/20 0.33
▸ DPP7 Q9UHL4 1/20 0.33
▸ MERTK Q12866 1/20 0.33
▸ SCN9A Q15858 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ ABL1 P00519 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ EIF2AK4 Q9P2K8 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
SCHEMBL30700450 0.82 GPR119 (0.38) HSD11B1LOXL2SCN9AKDM4EABL1
SCHEMBL30700149 0.82 LOXL2 (0.36) HSD11B1GAATDP1LOXL2PDK2
SCHEMBL30700206 0.81 MALT1 (0.35) MALT1HSD11B1ACACBLOXL2AXL
SCHEMBL30700052 0.80 KDM4E (0.41) HSD11B1GAATDP1PDK2CYP2D6
SCHEMBL25326125 0.78 MALT1 (0.38) MALT1LOXL2AXLTYRO3CYP2D6
SCHEMBL30553211 0.78 MALT1 (0.38) MALT1LOXL2AXLTYRO3CYP2D6
SCHEMBL30408287 0.77 MGLL (0.42) MALT1
SCHEMBL25145999 0.77 MGLL (0.42) MALT1
SCHEMBL30700376 0.77 ABHD6 (0.39) HSD11B1GAATDP1LOXL2SCN9A
SCHEMBL30700102 0.76 GAA (0.43) GAATDP1PDK2CYP2D6KDM4E

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 4 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
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