SCHEMBL30553185

SCHEMBL30553185

O=C(N1CC2(CC(Cc3ncc(F)cc3F)C2)C1)N1CC2(CC(c3nnc(C4(O)CC4)[nH]3)C2)C1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 7/20 0.36
▸ SPR P35270 1/20 0.31
▸ ADRA2C P18825 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
SCHEMBL25325185 1.00 MGLL (0.36) MGLLSPRADRA2C
SCHEMBL30553190 0.94 MGLL (0.33) MGLL
SCHEMBL25325690 0.94 MGLL (0.33) MGLL
SCHEMBL25326958 0.90 MGLL (0.39) MGLL
SCHEMBL30553193 0.90 MGLL (0.39) MGLL
SCHEMBL25327281 0.88 MGLL (0.40) MGLLSPRADRA2C
SCHEMBL25916218 0.86 ADRA2C (0.32) MGLLSPRADRA2C
SCHEMBL30553196 0.85 MGLL (0.37) MGLL
SCHEMBL25324147 0.85 MGLL (0.37) MGLL
SCHEMBL25326102 0.85 MGLL (0.36) MGLLSPRADRA2C

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-4469446-A1 NEW HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2024-12-04 — — EP claimed
WO-2023144160-A1 NEW HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-08-03 — — WO claimed
EP-4469446-A1 NEW HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2024-12-04 — — EP disclosed
WO-2023144160-A1 NEW HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-08-03 — — WO disclosed
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