SCHEMBL8486227

SCHEMBL8486227

CCN(CC)S(=O)(=O)c1ccc(C=CC(C)(O)C(F)(F)F)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 2/20 0.53
ABCC8 Q09428 2/20 0.53
KCNJ11 Q14654 2/20 0.53
KCNJ8 Q15842 2/20 0.53
POLB P06746 1/20 0.50
LMNA P02545 7/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
HTT P42858 3/20 0.47
ALDH1A1 P00352 5/20 0.47
MAPT P10636 2/20 0.47
NR2F2 P24468 1/20 0.47
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
MAPK1 P28482 1/20 0.46
PDK1 Q15118 1/20 0.45
PDK2 Q15119 1/20 0.45
PDK3 Q15120 1/20 0.45
PDK4 Q16654 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL8486225 1.00 ABCC9 (0.53) ABCC9ABCC8KCNJ11KCNJ8POLB
SCHEMBL8651887 0.78 NR1H3 (0.61) ABCC9ABCC8KCNJ11KCNJ8POLB
SCHEMBL8486205 0.78 NR1H3 (0.61) ABCC9ABCC8KCNJ11KCNJ8POLB
SCHEMBL9240562 0.76 HSD11B1 (0.57) ABCC9ABCC8KCNJ11KCNJ8MEN1
SCHEMBL8846861 0.76 HSD11B1 (0.57) ABCC9ABCC8KCNJ11KCNJ8MEN1
SCHEMBL8846896 0.76 HSD11B1 (0.57) ABCC9ABCC8KCNJ11KCNJ8MEN1
SCHEMBL8846856 0.76 HSD11B1 (0.57) ABCC9ABCC8KCNJ11KCNJ8MEN1
SCHEMBL9240828 0.74 ABCC9 (0.52) ABCC9ABCC8KCNJ11KCNJ8MEN1
SCHEMBL9240832 0.74 ABCC9 (0.52) ABCC9ABCC8KCNJ11KCNJ8MEN1
SCHEMBL4575111 0.73 LMNA (0.63) POLBLMNASMN1; SMN2HTTALDH1A1

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
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
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