SCHEMBL4607730

SCHEMBL4607730

N#Cc1ccc(-c2ccc(C3CCCC3N)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 8/20 0.49
MAOA P21397 1/20 0.48
GRIA4 P48058 1/20 0.45
CTSC P53634 5/20 0.43
KCNH2 Q12809 3/20 0.42
HRH3 Q9Y5N1 3/20 0.42
MAOB P27338 1/20 0.41
MMP3 P08254 1/20 0.40
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
NOS2 P35228 1/20 0.39
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39

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
SCHEMBL4607035 0.95 GRIA4 (0.48) KDM1AMAOAGRIA4CTSCKCNH2
SCHEMBL19585303 0.82 KDM1A (0.67) KDM1AMAOAKCNH2MAOB
SCHEMBL3633482 0.80 KDM1A (0.46) KDM1AMAOAHRH3MAOBMMP3
SCHEMBL4608402 0.80 ALDH1A1 (0.38) KDM1AMAOACTSCKCNH2MAOB
SCHEMBL4606554 0.79 KDM1A (0.66) KDM1AMAOAKCNH2MAOB
SCHEMBL4607726 0.77 HRH3 (0.46) KDM1AMAOAGRIA4CTSCKCNH2
SCHEMBL12976276 0.76 KDM1A (0.63) KDM1AMAOAKCNH2MAOB
SCHEMBL20656821 0.76 KDM1A (0.63) KDM1AMAOAKCNH2MAOB
SCHEMBL4607109 0.73 KDM1A (0.43) KDM1AMAOAGRIA4KCNH2MAOB
SCHEMBL4604973 0.73 KDM1A (0.61) KDM1AMAOAMAOBNOS3NOS1

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 8 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-A1 CYCLOPENTYL SULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2002-10-09 EP claimed
WO-2001042203-A1 CYCLOPENTYL SULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2001-06-14 WO 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