SCHEMBL30811990

SCHEMBL30811990

CC(C)(C)OC(=O)N1CCN(C2CN(c3cccc(OC4CCCCO4)c3)C2)CC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 4/20 0.47
▸ USP30 Q70CQ3 1/20 0.45
▸ HRH3 Q9Y5N1 1/20 0.42
▸ MAPT P10636 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ OPRM1 P35372 1/20 0.40
▸ OPRD1 P41143 1/20 0.40
▸ OGFRL1 Q5TC84 1/20 0.40
▸ NR1H2 P55055 1/20 0.40
▸ NR1H3 Q13133 1/20 0.40
▸ MGLL Q99685 2/20 0.40
▸ PDE4B Q07343 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
SCHEMBL5543361 0.91 GPR119 (0.53) GPR119USP30MAPTTP53NR1H2
SCHEMBL30812216 0.80 GPR119 (0.53) GPR119USP30MAPTNR1H2NR1H3
SCHEMBL5544207 0.79 NPY2R (0.42) GPR119HRH3MAPTPDE4B
SCHEMBL30812268 0.76 GPR119 (0.45) GPR119USP30MAPTTP53NR1H2
SCHEMBL15442067 0.75 GPR119 (0.64) GPR119MAPT
SCHEMBL25931020 0.74 GPR119 (0.44) GPR119USP30TP53PDE4B
SCHEMBL25931356 0.74 GPR119 (0.44) GPR119USP30TP53PDE4B
SCHEMBL30493371 0.74 GPR119 (0.44) GPR119USP30TP53PDE4B
SCHEMBL25931015 0.74 GPR119 (0.44) GPR119USP30TP53PDE4B
SCHEMBL28795341 0.70 ALDH1A1 (0.45) GPR119MAPTPDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024054956-A1 HETEROBIFUNCTIONAL COMPOUNDS AND METHODS OF TREATING DISEASE HALDA THERAPEUTICS OPCO, INC. (US) 2024-03-14 — — WO disclosed
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