SCHEMBL30700144

SCHEMBL30700144

O=C(N1CCC(CNS(=O)(=O)c2ccc(Cl)cc2)CC1)N1CC[C@H](c2ncn[nH]2)C1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 1/20 0.49
▸ KMT2A Q03164 4/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ TSHR P16473 1/20 0.44
▸ F10 P00742 2/20 0.44
▸ THRB P10828 2/20 0.41
▸ PKM P14618 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ HTT P42858 1/20 0.39
▸ TBXA2R P21731 1/20 0.39

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
SCHEMBL30700162 0.89 TGFBR1 (0.44) MGLLKMT2AMEN1SMN1; SMN2TSHR
SCHEMBL30700417 0.87 MGLL (0.44) MGLLPKMLMNAALDH1A1
SCHEMBL30700706 0.83 PSEN1 (0.41) MGLLKMT2AMEN1SMN1; SMN2TSHR
SCHEMBL30700719 0.77 TSHR (0.47) SMN1; SMN2TSHRALDH1A1HSD17B10HTT
SCHEMBL30699920 0.77 HTR1A (0.44) SMN1; SMN2
SCHEMBL30700193 0.74 PSEN1 (0.43) LMNA
SCHEMBL14834137 0.74 MGLL (0.65) MGLLKMT2AMEN1SMN1; SMN2TSHR
SCHEMBL30700269 0.74 F2 (0.38) MGLLF10
SCHEMBL21775388 0.74 MGLL (0.55) MGLLKMT2AMEN1SMN1; SMN2TSHR
SCHEMBL25323646 0.74 MGLL (0.49) MGLLKMT2AMEN1SMN1; SMN2TSHR

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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