SCHEMBL31399755

SCHEMBL31399755

CCN(C)c1nccc2c(S(=O)(=O)N3CCN(C(=O)OC(C)(C)C)C[C@H]3C)cccc12

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.43
▸ GPR119 Q8TDV5 10/20 0.41
▸ JAK3 P52333 1/20 0.39
▸ HTR6 P50406 2/20 0.38
▸ MMP1 P03956 1/20 0.37
▸ MMP3 P08254 1/20 0.37
▸ MMP7 P09237 1/20 0.37
▸ MMP9 P14780 1/20 0.37
▸ USP30 Q70CQ3 1/20 0.37
▸ ACHE P22303 1/20 0.37
▸ DTYMK P23919 1/20 0.36
▸ BCHE P06276 1/20 0.36

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
SCHEMBL31399749 0.84 CHRM1 (0.49) CNR1GPR119HTR6MMP1MMP3
SCHEMBL24177978 0.80 CNR1 (0.44) CNR1GPR119HTR6MMP1MMP9
SCHEMBL30439348 0.80 CNR1 (0.44) CNR1GPR119HTR6MMP1MMP9
SCHEMBL23795306 0.80 CNR1 (0.44) CNR1GPR119HTR6MMP1MMP9
SCHEMBL23810437 0.78 MMP13 (0.45) CNR1GPR119HTR6MMP1MMP3
SCHEMBL23795420 0.78 MMP13 (0.45) CNR1GPR119HTR6MMP1MMP3
SCHEMBL17962413 0.76 COMT (0.50) CNR1GPR119DTYMK
SCHEMBL23795367 0.73 PRKD3 (0.56) CNR1
SCHEMBL24178114 0.73 PRKD3 (0.56) CNR1
SCHEMBL15919223 0.73 MMP1 (0.48) CNR1GPR119MMP1MMP3MMP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4739672-A1 NEW COMPOUNDS Aston University (GB) 2026-05-13 — — EP disclosed
WO-2025008626-A1 NEW COMPOUNDS ASTON UNIVERSITY (GB) 2025-01-09 — — WO disclosed
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