SCHEMBL28029920

SCHEMBL28029920

CC(C)(C)NC(=O)O[C@@H](Cc1ccccc1)C(=O)C1(C)CO1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 1/20 0.49
▸ PSMB8 P28062 15/20 0.41
▸ PSMB5 P28074 14/20 0.40
▸ PSMB9 P28065 9/20 0.40
▸ PSMB1 P20618 7/20 0.40
▸ PSMB2 P49721 6/20 0.40
▸ PSMB10 P40306 5/20 0.39
▸ PSMB11 A5LHX3 4/20 0.39
▸ PSMA7 O14818 4/20 0.39
▸ PSMA1 P25786 4/20 0.39
▸ PSMA2 P25787 4/20 0.39
▸ PSMA3 P25788 4/20 0.39
▸ PSMA4 P25789 4/20 0.39
▸ PSMA5 P28066 4/20 0.39
▸ PSMB4 P28070 4/20 0.39
▸ PSMB6 P28072 4/20 0.39
▸ PSMB3 P49720 4/20 0.39
▸ PSMA6 P60900 4/20 0.39
▸ PSMA8 Q8TAA3 4/20 0.39
▸ PSMB7 Q99436 4/20 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
SCHEMBL27502333 0.82 SCN9A (0.57) SCN9A
SCHEMBL28336154 0.78 SCN9A (0.56) SCN9A
SCHEMBL27438213 0.76 SCN9A (0.54) SCN9A
SCHEMBL28628480 0.76 SCN9A (0.54) SCN9A
SCHEMBL28529040 0.76 SCN9A (0.53) SCN9A
SCHEMBL15568779 0.74 CTSS (0.58) PSMB8PSMB5PSMB9PSMB1PSMB2
SCHEMBL15568780 0.74 CTSS (0.58) PSMB8PSMB5PSMB9PSMB1PSMB2
SCHEMBL15568778 0.74 CTSS (0.58) PSMB8PSMB5PSMB9PSMB1PSMB2
SCHEMBL15594256 0.74 CTSS (0.58) PSMB8PSMB5PSMB9PSMB1PSMB2
SCHEMBL28029609 0.73 SCN9A (0.56) SCN9A

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
CN-104797591-A Fluorinated epoxyketone compounds and their use as proteasome inhibitors SLASSI ABDELMALIK 2015-07-22 — — CN disclosed
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