SCHEMBL4607035

SCHEMBL4607035

N#Cc1ccc(C2CCCC2N)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 1/20 0.48
KDM1A O60341 6/20 0.45
MAOA P21397 3/20 0.44
NOS3 P29474 1/20 0.42
NOS1 P29475 1/20 0.42
NOS2 P35228 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
TRPC6 Q9Y210 1/20 0.40
MAOB P27338 1/20 0.40
CTSC P53634 1/20 0.38
CYP19A1 P11511 5/20 0.37
CYP11B1 P15538 3/20 0.37
CYP11B2 P19099 3/20 0.37
KCNH2 Q12809 1/20 0.37
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL4607730 0.95 KDM1A (0.49) GRIA4KDM1AMAOANOS3NOS1
SCHEMBL20656821 0.80 KDM1A (0.63) KDM1AMAOAMAOBKCNH2
SCHEMBL12976276 0.80 KDM1A (0.63) KDM1AMAOAMAOBKCNH2
SCHEMBL4608247 0.76 KDM1A (0.39) KDM1AMAOAMAOBKCNH2
SCHEMBL19585303 0.76 KDM1A (0.67) KDM1AMAOAMAOBKCNH2
SCHEMBL4607031 0.75 HRH3 (0.49) GRIA4KDM1ANOS3NOS1NOS2
SCHEMBL4265573 0.75 KDM1A (0.63) GRIA4KDM1AMAOANOS3NOS1
SCHEMBL4260479 0.75 GRIA4 (0.45) GRIA4KDM1AMAOANOS3NOS1
SCHEMBL3717970 0.75 KDM1A (0.63) KDM1ANOS3NOS1NOS2HRH3
SCHEMBL1645757 0.75 KDM1A (0.63) KDM1ANOS3NOS1NOS2HRH3

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