SCHEMBL17022308

SCHEMBL17022308

CC(C)C[C@H](NC(=O)[C@H]1N[C@@H](c2ccccc2)[C@@H]([N+](=O)[O-])[C@@H]1c1ccccc1)OBO[C@H](CC(C)C)NC(=O)[C@H]1N[C@@H](c2ccccc2)[C@@H]([N+](=O)[O-])[C@@H]1c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.43
▸ ITGAL P20701 2/20 0.33

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
SCHEMBL17022414 1.00 GAA (0.43) GAAITGAL
SCHEMBL17022362 1.00 GAA (0.43) GAAITGAL
SCHEMBL17022343 1.00 GAA (0.43) GAAITGAL
SCHEMBL17022426 0.95 GAA (0.41) GAAITGAL
SCHEMBL17022400 0.95 GAA (0.41) GAAITGAL
SCHEMBL17022383 0.94 GAA (0.41) GAA
SCHEMBL17022305 0.92 GAA (0.39) GAA
SCHEMBL17022339 0.92 GAA (0.39) GAAITGAL
SCHEMBL17022418 0.91 GAA (0.37) GAA
SCHEMBL17022437 0.90 GAA (0.35) GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2910557-A1 Enantiopure tetrasubstituted pyrrolidines as scaffolds for proteasome inhibitors and medicinal applications thereof Ikerchem, S.L. (ES) 2015-08-26 — — EP claimed
WO-2015124663-A1 ENANTIOPURE TETRASUBSTITUTED PYRROLIDINES AS SCAFFOLDS FOR PROTEASOME INHIBITORS AND MEDICINAL APPLICATIONS THEREOF IKERCHEM, S.L. (ES) 2015-08-27 — — WO disclosed
EP-2910557-A1 Enantiopure tetrasubstituted pyrrolidines as scaffolds for proteasome inhibitors and medicinal applications thereof Ikerchem, S.L. (ES) 2015-08-26 — — EP disclosed
Send feedback