SCHEMBL4371167

SCHEMBL4371167

NC(=O)C1CCCC1c1ccc(I)cc1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 9/20 0.43
SLC6A2 P23975 8/20 0.43
SLC6A3 Q01959 8/20 0.43
GRIA4 P48058 2/20 0.42
SIRT2 Q8IXJ6 1/20 0.40
SIRT1 Q96EB6 1/20 0.40
EPHX1 P07099 1/20 0.36
KCNQ3 O43525 1/20 0.35
KCNQ2 O43526 1/20 0.35
HRH3 Q9Y5N1 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
SCHEMBL4371164 1.00 SLC6A4 (0.43) SLC6A4SLC6A2SLC6A3GRIA4SIRT2
SCHEMBL4608244 0.84 SIRT2 (0.40) SLC6A4SLC6A2SIRT2SIRT1EPHX1
SCHEMBL4605333 0.83 HRH3 (0.46) SLC6A4SLC6A2GRIA4SIRT2SIRT1
SCHEMBL4608380 0.83 SIRT2 (0.52) GRIA4SIRT2SIRT1
SCHEMBL4608144 0.83 SLC9A1 (0.50) SLC6A4SLC6A2SLC6A3SIRT2SIRT1
SCHEMBL4606990 0.83 ALDH1A1 (0.49) SLC6A4SLC6A2SLC6A3GRIA4SIRT2
SCHEMBL4606839 0.82 KCNQ3 (0.50) SLC6A4SLC6A2SLC6A3SIRT2SIRT1
SCHEMBL4606553 0.80 SLC6A2 (0.61) SLC6A4SLC6A2KCNQ3KCNQ2
SCHEMBL4607031 0.79 HRH3 (0.49) GRIA4EPHX1HRH3
SCHEMBL4606997 0.79 SLC6A2 (0.63) SLC6A4SLC6A2SLC6A3SIRT2SIRT1

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 9 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-1670757-B1 PYRROLE AND PYRAZOLE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS LILLY CO ELI (US) 2009-05-06 EP disclosed
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