SCHEMBL5230722

SCHEMBL5230722

O=S(=O)(Nc1ccc(Cl)cc1)c1ccc(Br)s1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.69
TP53 P04637 3/20 0.69
HTT P42858 7/20 0.59
KMT2A Q03164 6/20 0.58
MEN1 O00255 5/20 0.58
ALDH1A1 P00352 2/20 0.58
HPGD P15428 1/20 0.58
LMNA P02545 5/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
TSHR P16473 1/20 0.56
MAPK1 P28482 2/20 0.56
ALOX15 P16050 1/20 0.56
HSD17B10 Q99714 1/20 0.56
PKM P14618 2/20 0.53
CES1 P23141 1/20 0.53
THRB P10828 2/20 0.51
SGK1 O00141 1/20 0.51
NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL5229199 0.85 MAPT (0.68) MAPTTP53HTTKMT2AMEN1
SCHEMBL26010796 0.83 LMNA (0.62) MAPTTP53HTTKMT2AMEN1
SCHEMBL5231184 0.83 MAPT (0.68) MAPTTP53HTTKMT2AMEN1
SCHEMBL1346862 0.80 HTT (0.76) MAPTTP53HTTKMT2AMEN1
SCHEMBL5231919 0.80 MEN1 (0.60) MAPTTP53HTTKMT2AMEN1
SCHEMBL5230621 0.78 CES1 (0.50) MAPTTP53KMT2AMEN1ALDH1A1
SCHEMBL5230095 0.75 PRMT1 (0.52) MAPTTP53KMT2AMEN1ALDH1A1
SCHEMBL5229246 0.75 MEN1 (0.52) MAPTTP53KMT2AMEN1ALDH1A1
SCHEMBL5517767 0.74 HPGD (0.54) MAPTTP53HTTKMT2AMEN1
SCHEMBL24254327 0.74 HPGD (0.58) MAPTTP53HTTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1519932-B1 BISARYLSULFONAMIDE COMPOUNDS AND THEIR USE IN CANCER THERAPY CYCLACEL LTD (GB) 2007-10-03 EP claimed