SCHEMBL30865342

SCHEMBL30865342

O=C(N1CC2(CCN(Cc3cc(C(F)(F)F)no3)CC2)C1)N1CC2(CC(n3cnc(C4CC4)n3)C2)C1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 6/20 0.56
▸ USP2 O75604 11/20 0.33
▸ CYP3A4 P08684 10/20 0.33
▸ CYP2C19 P33261 3/20 0.33
▸ CYP2D6 P10635 7/20 0.32
▸ TSHR P16473 7/20 0.32
▸ CYP1A2 P05177 4/20 0.32
▸ CASP1 P29466 1/20 0.32
▸ CASP7 P55210 1/20 0.32
▸ CYP2C9 P11712 4/20 0.31
▸ SMYD3 Q9H7B4 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ HIF1A Q16665 1/20 0.30
▸ HDAC4 P56524 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
SCHEMBL30865261 0.93 MGLL (0.59) MGLL
SCHEMBL30865221 0.89 MGLL (0.43) MGLLUSP2CYP3A4CYP2C19CYP2D6
SCHEMBL30865236 0.87 MGLL (0.42) MGLLUSP2CYP3A4CYP2C19CYP2D6
SCHEMBL30865469 0.86 MGLL (0.55) MGLLUSP2CYP3A4CYP2C19CYP2D6
SCHEMBL30865447 0.84 MGLL (0.63) MGLLUSP2CYP3A4CYP2C19CYP2D6
SCHEMBL30013123 0.83 MGLL (0.55) MGLLUSP2CYP3A4CYP2C19CYP2D6
SCHEMBL30865471 0.83 MGLL (0.57) MGLLUSP2CYP3A4CYP2C19CYP2D6
SCHEMBL30865470 0.81 MGLL (0.45) MGLLUSP2
SCHEMBL30865120 0.81 MGLL (0.58) MGLLUSP2CYP3A4CYP2C19CYP2D6
SCHEMBL30865126 0.81 MGLL (0.54) MGLLUSP2CYP3A4CYP2C19CYP2D6

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4608823-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF MONOACYLGLYCEROL LIPASE (MAGL) F. Hoffmann-La Roche AG (CH) 2025-09-03 — — EP claimed
WO-2024088922-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF MONOACYLGLYCEROL LIPASE (MAGL) F. HOFFMANN-LA ROCHE AG (CH) 2024-05-02 — — WO claimed
EP-4608823-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF MONOACYLGLYCEROL LIPASE (MAGL) F. Hoffmann-La Roche AG (CH) 2025-09-03 — — EP disclosed
WO-2024088922-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF MONOACYLGLYCEROL LIPASE (MAGL) F. HOFFMANN-LA ROCHE AG (CH) 2024-05-02 — — WO disclosed
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