SCHEMBL4607031

SCHEMBL4607031

N#Cc1ccc(C2CCCC2C(N)=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.49
GRIA4 P48058 1/20 0.46
KDM1A O60341 6/20 0.44
KCNH2 Q12809 2/20 0.41
FASN P49327 2/20 0.40
EPHX1 P07099 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
DGAT1 O75907 1/20 0.40
CTSC P53634 1/20 0.39
NSD2 O96028 1/20 0.39
EPHX2 P34913 1/20 0.39
NOS3 P29474 1/20 0.38
NOS1 P29475 1/20 0.38
NOS2 P35228 1/20 0.38

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
SCHEMBL4607726 0.96 HRH3 (0.46) HRH3GRIA4KDM1AKCNH2FASN
SCHEMBL4608244 0.80 SIRT2 (0.40) HRH3EPHX1RAB9A
SCHEMBL4371164 0.79 SLC6A4 (0.43) HRH3GRIA4EPHX1
SCHEMBL4371167 0.79 SLC6A4 (0.43) HRH3GRIA4EPHX1
SCHEMBL4606990 0.79 ALDH1A1 (0.49) GRIA4KDM1AEPHX1
SCHEMBL4608380 0.79 SIRT2 (0.52) GRIA4
SCHEMBL4605333 0.79 HRH3 (0.46) HRH3GRIA4KDM1AKCNH2RAB9A
SCHEMBL4608144 0.79 SLC9A1 (0.50) HRH3KDM1AKCNH2
SCHEMBL4606839 0.78 KCNQ3 (0.50) HRH3KDM1A
SCHEMBL4608400 0.77 SLC6A2 (0.40) KCNH2CTSC

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