SCHEMBL4623155

SCHEMBL4623155

O=C(O)N1CCC[C@@H]1S(=O)(=O)Cl

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
DPP4 P27487 7/20 0.34
FAP Q12884 4/20 0.34
PREP P48147 3/20 0.34
DPP8 Q6V1X1 2/20 0.33
DPP9 Q86TI2 2/20 0.33
CA2 P00918 1/20 0.33
RIPK1 Q13546 1/20 0.33
ACE P12821 4/20 0.32
DPP7 Q9UHL4 2/20 0.32

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
SCHEMBL4623157 1.00 POLB (0.34) POLBL3MBTL1DPP4FAPPREP
SCHEMBL27368424 0.82 POLB (0.35) POLBL3MBTL1DPP4FAPPREP
SCHEMBL2707073 0.80 CA2 (0.39) POLBL3MBTL1DPP4FAPPREP
SCHEMBL21807152 0.80 DPP4 (0.37) POLBL3MBTL1DPP4FAPPREP
SCHEMBL4893081 0.74 GAA (0.36) POLBL3MBTL1DPP4FAPPREP
SCHEMBL4624823 0.74 HSD17B10 (0.47)
SCHEMBL26984528 0.72 RAB9A (0.38) L3MBTL1CA2ACE
SCHEMBL27094468 0.71 GAA (0.33) L3MBTL1DPP4FAPPREPCA2
SCHEMBL10525888 0.68 ACE (0.35) POLBL3MBTL1DPP4FAPPREP
SCHEMBL5171312 0.67 ALDH1A1 (0.50) POLB

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-1948597-A1 DERIVATIVES FOR MODULATION OF ION CHANNELS Vertex Pharmaceuticals Incorporated (US) 2008-07-30 EP disclosed
WO-2007050522-A1 DERIVATIVES FOR MODULATION OF ION CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-05-03 WO disclosed