SCHEMBL30699995

SCHEMBL30699995

O=C(N1CCC2(CC1)CC(Oc1ccc(C(F)(F)F)cc1F)C2)N1CCC(c2ncn[nH]2)C1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 4/20 0.38
▸ PDE2A O00408 1/20 0.34
▸ ENPP2 Q13822 3/20 0.34
▸ ATXN2 Q99700 3/20 0.34
▸ EPHX2 P34913 1/20 0.33
▸ PIM1 P11309 1/20 0.33
▸ BTK Q06187 3/20 0.33
▸ DDR1 Q08345 1/20 0.33
▸ CHRNA7 P36544 1/20 0.33
▸ PAK1 Q13153 1/20 0.32
▸ MAPK7 Q13164 1/20 0.32
▸ RBP4 P02753 1/20 0.32

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
SCHEMBL30699875 0.84 MGLL (0.42) MGLL
SCHEMBL30700691 0.84 MGLL (0.42) MGLL
SCHEMBL23150501 0.79 MGLL (0.60) MGLL
SCHEMBL23853805 0.79 MGLL (0.60) MGLL
SCHEMBL25784982 0.79 MGLL (0.60) MGLL
SCHEMBL23176605 0.79 MGLL (0.60) MGLL
SCHEMBL23150502 0.79 MGLL (0.60) MGLL
SCHEMBL29511866 0.79 MGLL (0.60) MGLL
SCHEMBL30700335 0.79 MGLL (0.44) MGLLENPP2ATXN2PIM1
SCHEMBL32685334 0.78 MGLL (0.44) MGLLENPP2ATXN2EPHX2

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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