SCHEMBL30700566

SCHEMBL30700566

O=C(N1CC[C@H](n2cnnn2)C1)N1CC2(CC(c3ccc(F)cc3)C2)C1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 5/20 0.36
▸ RAB9A P51151 3/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ ATM Q13315 2/20 0.35
▸ MAPT P10636 2/20 0.34
▸ MGLL Q99685 3/20 0.34
▸ FAAH O00519 2/20 0.34
▸ SIGMAR1 Q99720 1/20 0.33
▸ KMT2A Q03164 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ PARP10 Q53GL7 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ KDM1A O60341 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ L3MBTL1 Q9Y468 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
SCHEMBL30700054 0.89 MGLL (0.40) RORCMGLL
SCHEMBL30700014 0.83 MGLL (0.37) MGLL
SCHEMBL30700532 0.82 PARP10 (0.44) RORCRAB9ANPC1ATMMAPT
SCHEMBL27291568 0.82 PARP10 (0.44) RORCRAB9ANPC1ATMMAPT
SCHEMBL30700128 0.82 PARP10 (0.44) RORCRAB9ANPC1ATMMAPT
SCHEMBL30700283 0.81 MGLL (0.37) MGLL
SCHEMBL30700677 0.78 MGLL (0.40) MGLL
SCHEMBL30700328 0.77 MGLL (0.36) MGLL
SCHEMBL30700235 0.77 MGLL (0.36) MGLL
SCHEMBL30700049 0.76 MGLL (0.37) 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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