SCHEMBL8525296

SCHEMBL8525296

CN(c1ccccc1)S(=O)(=O)c1ccc(C#CC(C)(O)C(F)(F)F)cc1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 10/20 0.64
NR1H3 Q13133 7/20 0.61
ABCC9 O60706 1/20 0.56
ABCC8 Q09428 1/20 0.56
KCNJ11 Q14654 1/20 0.56
KCNJ8 Q15842 1/20 0.56
CA12 O43570 1/20 0.50
CA9 Q16790 1/20 0.50
TSHR P16473 2/20 0.47
POLB P06746 1/20 0.47
MAPK1 P28482 1/20 0.47

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
SCHEMBL8846776 0.81 HSD11B1 (0.57) NR1H2ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL4611444 0.78 NR1H2 (1.00) NR1H2NR1H3
SCHEMBL8490608 0.78 ABCC9 (0.53) NR1H2ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL9794436 0.76 MAPT (0.50) NR1H2NR1H3TSHR
SCHEMBL8486205 0.72 NR1H3 (0.61) NR1H2NR1H3ABCC9ABCC8KCNJ11
SCHEMBL8651887 0.72 NR1H3 (0.61) NR1H2NR1H3ABCC9ABCC8KCNJ11
SCHEMBL8837620 0.72 CA12 (0.65) NR1H3CA12CA9TSHRPOLB
SCHEMBL8492310 0.72 ABCC9 (1.00) NR1H2NR1H3ABCC9ABCC8KCNJ11
SCHEMBL8847204 0.72 ABCC9 (0.50) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL8846852 0.71 ABCC9 (0.52) NR1H2ABCC9ABCC8KCNJ11KCNJ8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999062873-A1 BENZENESULPHONAMIDE DERIVATIVES AS PYRUVATE DEHYDROGENASE ACTIVATORS ASTRAZENECA AB (SE) 1999-12-09 WO claimed
EP-0625516-B1 Benzenesulphonamide derivatives for the treatment of bladder instability ZENECA LTD (GB) 1998-09-09 EP claimed
WO-1999062873-A1 BENZENESULPHONAMIDE DERIVATIVES AS PYRUVATE DEHYDROGENASE ACTIVATORS ASTRAZENECA AB (SE) 1999-12-09 WO disclosed
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