SCHEMBL5505149

SCHEMBL5505149

CCCCCC#C[C](O)CS(=O)(=O)N1CCN(c2ccccc2OC)CC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.50
TP53 P04637 2/20 0.50
GFER P55789 1/20 0.50
MAPT P10636 1/20 0.50
HTR1A P08908 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
TSHR P16473 1/20 0.49
HTT P42858 1/20 0.49
ALDH1A1 P00352 2/20 0.48
DRD2 P14416 2/20 0.48
DRD3 P35462 1/20 0.48
HSD17B10 Q99714 1/20 0.48
LMNA P02545 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
POLB P06746 1/20 0.45

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
SCHEMBL16493628 0.84 TP53 (0.56) GAATP53GFERMAPTHTR1A
SCHEMBL5500882 0.82 LMNA (0.46) GAATP53MAPTSMN1; SMN2TSHR
SCHEMBL5506031 0.81 THRB (0.46) TP53MAPTSMN1; SMN2ALDH1A1DRD2
SCHEMBL16493627 0.81 HTR1A (0.51) GAATP53GFERMAPTHTR1A
SCHEMBL2155613 0.79 MAPT (0.49) GAATP53GFERMAPTHTR1A
SCHEMBL27713615 0.78 MAPT (0.49) GAATP53GFERMAPTHTR1A
SCHEMBL2154795 0.77 MAPT (0.49) TP53MAPTHTR1ASMN1; SMN2TSHR
SCHEMBL2155291 0.77 SMN1; SMN2 (0.57) GAATP53GFERMAPTHTR1A
SCHEMBL2155293 0.77 SMN1; SMN2 (0.57) GAATP53GFERMAPTHTR1A
SCHEMBL2154790 0.76 TP53 (0.45) GAATP53GFERMAPTHTR1A

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 4 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 claimed
WO-2006067114-A1 SULFONYL AMINO CYCLIC DERIVATIVES AND USE THEREOF LABORATOIRES SERONO S.A. (CH) 2006-06-29 WO claimed
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