SCHEMBL765296

SCHEMBL765296

CC(C)(C)OC(=O)N1CC(O)[C@@H](NC(=O)OCc2ccccc2)C1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.56
PDE4B Q07343 1/20 0.49
USP30 Q70CQ3 1/20 0.47
CPB1 P15086 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
BACE1 P56817 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
STS P08842 1/20 0.43
CTSL P07711 2/20 0.43
SYK P43405 1/20 0.43
NAMPT P43490 1/20 0.43
CTSB P07858 1/20 0.43

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
SCHEMBL3741626 1.00 CTSK (0.56) CTSKPDE4BUSP30CPB1MEN1
SCHEMBL19064067 1.00 CTSK (0.56) CTSKPDE4BUSP30CPB1MEN1
SCHEMBL2537459 1.00 CTSK (0.56) CTSKPDE4BUSP30CPB1MEN1
SCHEMBL2992126 1.00 CTSK (0.56) CTSKPDE4BUSP30CPB1MEN1
SCHEMBL2534996 1.00 CTSK (0.56) CTSKPDE4BUSP30CPB1MEN1
SCHEMBL29187991 0.92 USP30 (0.49) CTSKPDE4BUSP30CPB1MEN1
SCHEMBL30158823 0.92 USP30 (0.49) CTSKPDE4BUSP30CPB1MEN1
SCHEMBL29187989 0.92 USP30 (0.49) CTSKPDE4BUSP30CPB1MEN1
SCHEMBL30411534 0.92 USP30 (0.49) CTSKPDE4BUSP30CPB1MEN1
SCHEMBL23938305 0.91 PDE4B (0.58) CTSKPDE4BUSP30MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1565436-B1 3-AMINOPYRROLIDINE DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTORS INCYTE CORP (US) 2012-04-25 EP disclosed
EP-2431357-A2 3-Aminopyrrolidine Derivatives as Modulators of Chemokine Receptors Incyte Corporation (US) 2012-03-21 EP disclosed