SCHEMBL30700014

SCHEMBL30700014

O=C(N1CC[C@H](n2cnnn2)C1)N1CC2(CC(c3cnc(C(F)(F)F)nc3)C2)C1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 6/20 0.37
▸ IDO1 P14902 1/20 0.34
▸ VNN1 O95497 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
SCHEMBL30700054 0.87 MGLL (0.40) MGLLIDO1
SCHEMBL30700566 0.83 RORC (0.36) MGLL
SCHEMBL30700087 0.78 MGLL (0.43) MGLLIDO1
SCHEMBL30699870 0.78 MGLL (0.43) MGLLIDO1
SCHEMBL30700094 0.76 LOXL2 (0.38) MGLLIDO1
SCHEMBL30700230 0.76 LOXL2 (0.38) MGLLIDO1
SCHEMBL30700468 0.76 LOXL2 (0.38) MGLLIDO1
SCHEMBL30700071 0.74 MGLL (0.37) MGLL
SCHEMBL30700049 0.74 MGLL (0.37) MGLL
SCHEMBL30700903 0.74 MGLL (0.40) MGLLIDO1

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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