SCHEMBL22756160

SCHEMBL22756160

CNC(Cc1ccc(-c2ncc(-c3ccc(OCCC4CCCCC4)cc3)cn2)cc1)C(=O)NCCC(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 3/20 0.39
▸ PSMB1 P20618 2/20 0.39
▸ PSMB8 P28062 2/20 0.39
▸ PSMB9 P28065 2/20 0.39
▸ BCHE P06276 1/20 0.39
▸ ACACB O00763 1/20 0.36
▸ ITGB3 P05106 4/20 0.36
▸ ITGA2B P08514 4/20 0.36
▸ PSMB10 P40306 1/20 0.36
▸ PSMB2 P49721 1/20 0.36
▸ REN P00797 1/20 0.35
▸ CTSS P25774 2/20 0.35
▸ CTSK P43235 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ BCL2 P10415 1/20 0.34
▸ PLG P00747 1/20 0.34
▸ PRSS1 P07477 1/20 0.34
▸ PRSS2 P07478 1/20 0.34
▸ PRSS3 P35030 1/20 0.34

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
SCHEMBL16375225 0.90 CTSS (0.42) PSMB5PSMB1PSMB8PSMB9BCHE
SCHEMBL22384200 0.90 CTSS (0.42) PSMB5PSMB1PSMB8PSMB9BCHE
SCHEMBL22756206 0.85 RARB (0.42) PSMB5ITGB3ITGA2BCTSSCTSK
SCHEMBL22384114 0.83 CTSS (0.44) CTSSCTSKBCL2
SCHEMBL16294799 0.81 CTSS (0.45) CTSSCTSK
SCHEMBL16294798 0.81 CTSS (0.45) CTSSCTSK
SCHEMBL22756131 0.80 CTSS (0.42) PSMB5CTSSCTSKBCL2
SCHEMBL16306026 0.79 CTSS (0.37) PSMB5PSMB1PSMB8PSMB9ACACB
SCHEMBL16305975 0.77 CTSS (0.40) ACACBITGB3ITGA2BCTSS
SCHEMBL22384055 0.76 L3MBTL1 (0.42) PSMB5ITGB3ITGA2BCTSSCTSK

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
EP-3008056-B1 NOVEL GLP-1 RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2020-12-09 — — EP disclosed
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