SCHEMBL30700413

SCHEMBL30700413

O=C(N1CCC(c2nnc[nH]2)C1)N1CC2(CC(Oc3cncc(Cl)c3)C2)C1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ABHD6 Q9BV23 3/20 0.39
▸ CHRNB2 P17787 2/20 0.36
▸ CHRNA4 P43681 2/20 0.36
▸ CYP11B2 P19099 5/20 0.34
▸ GRIN1 Q05586 1/20 0.33
▸ GRIN2B Q13224 1/20 0.33
▸ SPR P35270 1/20 0.32
▸ NPC1 O15118 2/20 0.32
▸ ADORA1 P30542 1/20 0.32
▸ RAB9A P51151 1/20 0.31
▸ PIK3CD O00329 1/20 0.31
▸ PIK3CA P42336 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
SCHEMBL30700263 0.88 ABHD6 (0.42) ABHD6PIK3CDPIK3CA
SCHEMBL30700303 0.85 LPL (0.35) CHRNB2CHRNA4
SCHEMBL30700320 0.80 MGLL (0.40) —
SCHEMBL30700074 0.75 MGLL (0.33) ABHD6
SCHEMBL30700375 0.72 LOXL2 (0.36) ABHD6
SCHEMBL30700438 0.72 EGFR (0.35) SPRNPC1RAB9A
SCHEMBL30700390 0.70 GPBAR1 (0.36) —
SCHEMBL30700551 0.70 JAK2 (0.33) —
SCHEMBL30012054 0.70 MGLL (0.52) ABHD6CHRNB2CHRNA4CYP11B2GRIN1
SCHEMBL27149157 0.70 MGLL (0.52) ABHD6CHRNB2CHRNA4CYP11B2GRIN1

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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