SCHEMBL4606753

SCHEMBL4606753

NC1CCCC1c1ccc(-c2ccc(F)cc2F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 9/20 0.42
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
KDM1B Q8NB78 2/20 0.38
CYP3A4 P08684 3/20 0.38
APP P05067 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
DPP4 P27487 1/20 0.36
KCNH2 Q12809 2/20 0.36
HTR2A P28223 1/20 0.36
GRM2 Q14416 1/20 0.36
TDP2 O95551 1/20 0.36
NOS3 P29474 3/20 0.35
NOS2 P35228 3/20 0.35
NOS1 P29475 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35

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
SCHEMBL7898071 0.81 KDM1A (0.63) KDM1AMAOBKDM1BKCNH2HTR2A
SCHEMBL17864289 0.81 KDM1A (0.63) KDM1AMAOBKDM1BKCNH2HTR2A
SCHEMBL4260027 0.81 KDM1A (0.63) KDM1AMAOBKDM1BKCNH2HTR2A
SCHEMBL1645757 0.81 KDM1A (0.63) KDM1AMAOBKDM1BKCNH2HTR2A
SCHEMBL3717972 0.81 KDM1A (0.63) KDM1AMAOBKDM1BKCNH2HTR2A
SCHEMBL3717970 0.81 KDM1A (0.63) KDM1AMAOBKDM1BKCNH2HTR2A
SCHEMBL4606744 0.80 KDM1A (0.43) KDM1AMAOAMAOBCYP3A4APP
SCHEMBL4607109 0.78 KDM1A (0.43) KDM1AMAOAMAOBKDM1BKCNH2
SCHEMBL13598557 0.77 KDM1A (0.63) KDM1AMAOBKDM1BKCNH2HTR2A
SCHEMBL4607509 0.74 HTR2A (0.50) KDM1AKDM1BKCNH2HTR2ANOS3

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