SCHEMBL8646353

SCHEMBL8646353

C#Cc1ccc(S(=O)(=O)N2CCCC2)cc1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.68
POLB P06746 2/20 0.58
ALDH1A1 P00352 3/20 0.56
GAA P10253 3/20 0.56
PKM P14618 2/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
TSHR P16473 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
HTT P42858 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
NPC1 O15118 1/20 0.53
MAPT P10636 1/20 0.53
RAB9A P51151 1/20 0.53
LMNA P02545 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL3633792 0.80 USP2 (0.71) USP2POLBALDH1A1GAAPKM
SCHEMBL3373909 0.79 USP2 (0.76) USP2POLBALDH1A1GAAPKM
SCHEMBL13271173 0.78 USP2 (0.62) USP2POLBALDH1A1GAAPKM
SCHEMBL3843538 0.75 CA12 (0.67) ALDH1A1GAAPKMMEN1KMT2A
SCHEMBL2706987 0.75 USP2 (0.76) USP2POLBALDH1A1GAAPKM
SCHEMBL436674 0.75 PKM (0.89) USP2POLBALDH1A1GAAPKM
SCHEMBL2705461 0.75 L3MBTL1 (0.83) USP2POLBALDH1A1GAAMEN1
SCHEMBL2112295 0.75 USP2 (0.76) USP2POLBALDH1A1GAAPKM
SCHEMBL1046239 0.75 USP2 (0.76) USP2POLBALDH1A1GAAPKM
SCHEMBL6748039 0.75 USP2 (0.76) USP2POLBALDH1A1GAAPKM

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-0625516-B1 Benzenesulphonamide derivatives for the treatment of bladder instability ZENECA LTD (GB) 1998-09-09 EP disclosed
US-5693639-A TREATING URINARY INCONTINENCE ZENECA LIMITED (GB) 1997-12-02 US disclosed
US-5510386-A ADMINISTERING TO RELAX SMOOTH MUSCLE OF THE BLADDER ZENECA LIMITED (GB) 1996-04-23 US disclosed
EP-0625516-A1 Benzenesulphonamide derivatives for the treatment of bladder instability ZENECA LIMITED (GB) 1994-11-23 EP disclosed