SCHEMBL30700551

SCHEMBL30700551

O=C(N1CCC(c2nnc[nH]2)C1)N1CC2(CC(CN3CCC(F)(F)CC3)C2)C1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 2/20 0.33
▸ JAK1 P23458 2/20 0.33
▸ JAK3 P52333 2/20 0.33
▸ MGLL Q99685 5/20 0.31
▸ TLR9 Q9NR96 2/20 0.31
▸ TLR8 Q9NR97 2/20 0.31
▸ TLR7 Q9NYK1 2/20 0.31
▸ TYK2 P29597 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
SCHEMBL30700074 0.77 MGLL (0.33) MGLL
SCHEMBL30700238 0.76 ADRA2C (0.35) MGLL
SCHEMBL30700337 0.76 SCN9A (0.33) —
SCHEMBL30700475 0.75 MGLL (0.38) JAK2JAK1JAK3MGLLTYK2
SCHEMBL25325295 0.75 JAK2 (0.33) JAK2JAK1JAK3MGLLTYK2
SCHEMBL30700215 0.74 GPBAR1 (0.37) MGLL
SCHEMBL30700327 0.73 GPR119 (0.34) MGLL
SCHEMBL30700221 0.73 MGLL (0.39) MGLL
SCHEMBL30700390 0.72 GPBAR1 (0.36) JAK3MGLL
SCHEMBL30700668 0.72 MGLL (0.36) MGLL

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 5 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
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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