SCHEMBL8649261

SCHEMBL8649261

CCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.71
ALDH1A1 P00352 6/20 0.70
TSHR P16473 1/20 0.70
HSD17B10 Q99714 1/20 0.70
LMNA P02545 2/20 0.70
TDP1 Q9NUW8 1/20 0.69
ATAD2 Q6PL18 2/20 0.67
MEN1 O00255 3/20 0.66
CYP3A4 P08684 1/20 0.66
CYP2C9 P11712 1/20 0.66
CYP2C19 P33261 1/20 0.66
POLB P06746 1/20 0.65
MAPT P10636 1/20 0.65

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
SCHEMBL8645371 0.99 KMT2A (0.73) KMT2AALDH1A1TSHRHSD17B10LMNA
SCHEMBL8646474 0.86 ALDH1A1 (0.63) KMT2AALDH1A1TSHRHSD17B10LMNA
SCHEMBL8644045 0.86 ALDH1A1 (0.81) KMT2AALDH1A1MEN1CYP3A4CYP2C9
SCHEMBL31195227 0.86 ALDH1A1 (0.72) KMT2AALDH1A1TSHRHSD17B10LMNA
SCHEMBL10282744 0.84 KMT2A (0.61) KMT2AALDH1A1TSHRLMNATDP1
SCHEMBL4070839 0.84 ALDH1A1 (0.84) KMT2AALDH1A1TSHRLMNATDP1
SCHEMBL3300404 0.82 ALDH1A1 (0.84) KMT2AALDH1A1TSHRLMNATDP1
SCHEMBL17131816 0.81 TSHR (0.77) KMT2AALDH1A1TSHRHSD17B10LMNA
SCHEMBL31195221 0.81 ALDH1A1 (0.66) KMT2AALDH1A1TSHRHSD17B10LMNA
SCHEMBL165282 0.81 KMT2A (0.69) KMT2AALDH1A1HSD17B10LMNAMEN1

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 5 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 claimed
EP-0625516-A1 Benzenesulphonamide derivatives for the treatment of bladder instability ZENECA LIMITED (GB) 1994-11-23 EP claimed
EP-2258356-B1 CHEMICAL COMPOUNDS HAVING ANTIVIRAL ACTIVITY AGAINST DENGUE VIRUS AND OTHER FLAVIVIRUSES CT INGENIERIA GENETICA BIOTECNOLOGIA (CU) 2017-09-27 EP disclosed
EP-0625516-B1 Benzenesulphonamide derivatives for the treatment of bladder instability ZENECA LTD (GB) 1998-09-09 EP disclosed
EP-0625516-A1 Benzenesulphonamide derivatives for the treatment of bladder instability ZENECA LIMITED (GB) 1994-11-23 EP disclosed