SCHEMBL4604598

SCHEMBL4604598

CN(C)S(=O)(=O)N[C@@H]1CCC[C@@H]1c1ccc(-c2cccc(NS(C)(=O)=O)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 7/20 0.58
GRIA2 P42262 5/20 0.53
KCNH2 Q12809 4/20 0.53
KIF11 P52732 1/20 0.46
BRD4 O60885 1/20 0.44
TDP2 O95551 2/20 0.43
PIK3CD O00329 1/20 0.42
PIK3CG P48736 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
USP2 O75604 2/20 0.41
LMNA P02545 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
MAPK1 P28482 2/20 0.41
CLK4 Q9HAZ1 2/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
CYP2C19 P33261 1/20 0.41
GRIA4 P48058 1/20 0.40

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
SCHEMBL4604595 1.00 KDM1A (0.58) KDM1AGRIA2KCNH2KIF11BRD4
SCHEMBL4607295 0.85 GRIA2 (0.73) KDM1AGRIA2KCNH2GRIA4
SCHEMBL4605918 0.85 GRIA2 (0.73) KDM1AGRIA2KCNH2GRIA4
SCHEMBL14141327 0.85 GRIA2 (0.73) KDM1AGRIA2KCNH2GRIA4
SCHEMBL4605917 0.80 KDM1A (0.77) KDM1AGRIA2KCNH2KIF11BRD4
SCHEMBL4606536 0.76 GRIA4 (0.65) GRIA2GRIA4
SCHEMBL4606538 0.76 GRIA4 (0.65) GRIA2GRIA4
SCHEMBL4605913 0.76 KDM1A (0.64) KDM1AGRIA2KCNH2KIF11BRD4
SCHEMBL25964972 0.75 KDM1A (0.69) KDM1AGRIA2KCNH2KIF11BRD4
SCHEMBL15136959 0.74 KDM1A (1.00) KDM1AGRIA2KCNH2KIF11MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1246797-B1 CYCLOPENTYL SULFONAMIDE DERIVATIVES LILLY CO ELI (US) 2008-07-23 EP claimed
US-6639107-B1 Potentiating glutamate receptor function ELI LILLY AND COMPANY 2003-10-28 US claimed
EP-1246797-B1 CYCLOPENTYL SULFONAMIDE DERIVATIVES LILLY CO ELI (US) 2008-07-23 EP disclosed
US-6639107-B1 Potentiating glutamate receptor function ELI LILLY AND COMPANY 2003-10-28 US disclosed
EP-1246797-A1 CYCLOPENTYL SULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2002-10-09 EP disclosed
WO-2001042203-A1 CYCLOPENTYL SULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2001-06-14 WO disclosed