SCHEMBL8350392

SCHEMBL8350392

CN(CC(=O)N1CC[C@@H]2[C@H]1C(=O)CN2C(=O)c1ccccc1)C(=O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.55
▸ PREP P48147 1/20 0.55
▸ FAP Q12884 1/20 0.55
▸ CTSK P43235 4/20 0.53
▸ ACHE P22303 1/20 0.39
▸ ITGB3 P05106 3/20 0.39
▸ ITGA2B P08514 3/20 0.39
▸ CTSS P25774 1/20 0.36
▸ CNR2 P34972 2/20 0.35
▸ CNR1 P21554 1/20 0.35

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
SCHEMBL8349856 0.94 CTSK (0.62) DPP4PREPFAPCTSKACHE
SCHEMBL13909124 0.79 CTSK (0.63) DPP4PREPFAPCTSKCTSS
SCHEMBL13909135 0.78 CTSK (0.55) DPP4PREPFAPCTSKCTSS
SCHEMBL8347301 0.77 CTSK (0.68) DPP4PREPFAPCTSKCTSS
SCHEMBL6211132 0.77 CTSK (0.52) DPP4CTSKACHECTSSCNR2
SCHEMBL8348491 0.75 CTSK (0.48) DPP4PREPFAPCTSKITGB3
SCHEMBL13909142 0.74 CTSK (0.48) PREPCTSKCTSS
SCHEMBL5941982 0.74 CTSK (0.72) CTSKCTSS
SCHEMBL5941978 0.74 CTSK (0.72) CTSKCTSS
SCHEMBL4048380 0.74 CTSK (0.64) DPP4FAPCTSKCTSSCNR2

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-2004007501-A1 BIOLOGICALLY ACTIVE COMPOUNDS AMURA THERAPEUTICS LIMITED (GB) 2004-01-22 — — WO disclosed
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