SCHEMBL30700013

SCHEMBL30700013

O=C(N1CC(c2cnc(Oc3ccc(Cl)cc3)cn2)C1)N1CC[C@H](n2cnnn2)C1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.40
KCNH2 Q12809 1/20 0.40
BTK Q06187 14/20 0.36
EGFR P00533 8/20 0.36
RXRB P28702 1/20 0.35
TRPC6 Q9Y210 1/20 0.33
SRC P12931 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
SCHEMBL30699944 0.88 CHRM4 (0.35) HRH3BTKRXRB
SCHEMBL30700586 0.88 CHRM4 (0.35) HRH3BTKRXRB
SCHEMBL30700483 0.86 HRH3 (0.43) HRH3RXRB
SCHEMBL30700060 0.86 HRH3 (0.43) HRH3RXRB
SCHEMBL30700439 0.80 SCN9A (0.38) HRH3KCNH2
SCHEMBL30699964 0.77 SCN9A (0.40) HRH3KCNH2
SCHEMBL27291672 0.77 SCN9A (0.40) HRH3KCNH2
SCHEMBL30700532 0.75 PARP10 (0.44) HRH3KCNH2BTKTRPC6
SCHEMBL30700128 0.75 PARP10 (0.44) HRH3KCNH2BTKTRPC6
SCHEMBL27291568 0.75 PARP10 (0.44) HRH3KCNH2BTKTRPC6

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