SCHEMBL4608450

SCHEMBL4608450

NC(=O)C1CCCC1c1ccc(F)c(F)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 1/20 0.46
SIRT2 Q8IXJ6 1/20 0.43
SIRT1 Q96EB6 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
SLC9A1 P19634 1/20 0.41
KDM1A O60341 7/20 0.40
MAOA P21397 1/20 0.40
NR3C2 P08235 1/20 0.39
MAOB P27338 1/20 0.38
GRM4 Q14833 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL4608144 0.82 SLC9A1 (0.50) SIRT2SIRT1HTR2AHTR2CHTR2B
SCHEMBL808740 0.82 SLC9A1 (0.54) HTR2AHTR2CHTR2BSLC9A1KDM1A
SCHEMBL2397845 0.82 SLC9A1 (0.54) HTR2AHTR2CHTR2BSLC9A1KDM1A
SCHEMBL4607572 0.80 GRIA4 (0.47) GRIA4SIRT2SIRT1HTR2AHTR2C
SCHEMBL4608380 0.79 SIRT2 (0.52) GRIA4SIRT2SIRT1SLC9A1GRM4
SCHEMBL4607106 0.78 SLC6A4 (0.43) SIRT2SIRT1SLC9A1KDM1ANR3C2
SCHEMBL4608244 0.77 SIRT2 (0.40) SIRT2SIRT1SLC9A1NR3C2RAB9A
SCHEMBL4606744 0.76 KDM1A (0.43) SLC9A1KDM1AMAOANR3C2MAOB
SCHEMBL4371164 0.76 SLC6A4 (0.43) GRIA4SIRT2SIRT1
SCHEMBL4606990 0.76 ALDH1A1 (0.49) GRIA4SIRT2SIRT1HTR2AHTR2C

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