SCHEMBL5504337

SCHEMBL5504337

O=CN(O)CC#CCS(=O)(=O)N1CCN(c2ccccn2)CC1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.57
ALDH1A1 P00352 3/20 0.57
MAPT P10636 1/20 0.57
HSD17B10 Q99714 1/20 0.53
CTSS P25774 2/20 0.46
LMNA P02545 1/20 0.44
F13A1 P00488 1/20 0.44
TGM2 P21980 1/20 0.44
TGM1 P22735 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
USP30 Q70CQ3 1/20 0.42
MMP7 P09237 1/20 0.41
SORD Q00796 1/20 0.41
POLB P06746 1/20 0.41
PKM P14618 1/20 0.41

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
SCHEMBL2156392 0.74 KDM4E (0.55) KDM4EALDH1A1MAPTHSD17B10CTSS
SCHEMBL7363493 0.74 KDM4E (0.52) KDM4EALDH1A1MAPTHSD17B10CTSS
SCHEMBL12463845 0.73 KDM4E (0.56) KDM4EALDH1A1MAPTHSD17B10CTSS
SCHEMBL2155256 0.72 KDM4E (0.55) KDM4EALDH1A1MAPTHSD17B10CTSS
SCHEMBL12463849 0.72 MMP7 (0.61) KDM4EALDH1A1MAPTHSD17B10CTSS
SCHEMBL2155302 0.72 KDM4E (0.54) KDM4EALDH1A1MAPTHSD17B10CTSS
SCHEMBL2155000 0.72 KDM4E (0.51) KDM4EALDH1A1MAPTHSD17B10CTSS
SCHEMBL2155157 0.70 KDM4E (0.52) KDM4EALDH1A1MAPTHSD17B10CTSS
SCHEMBL14252763 0.70 MMP7 (0.61) KDM4EALDH1A1MAPTHSD17B10CTSS
SCHEMBL4816679 0.70 MMP7 (0.61) KDM4EALDH1A1MAPTHSD17B10CTSS

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-1828160-A1 SULFONYL AMINO CYCLIC DERIVATIVES AND USE THEREOF AS MMP INHIBITORS LABORATOIRES SERONO S.A. (CH) 2007-09-05 EP disclosed
WO-2006067114-A1 SULFONYL AMINO CYCLIC DERIVATIVES AND USE THEREOF LABORATOIRES SERONO S.A. (CH) 2006-06-29 WO disclosed