SCHEMBL4608400

SCHEMBL4608400

N#CCc1ccc(-c2ccc(C3CCCC3C(N)=O)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
CTSC P53634 5/20 0.38
CYP11B2 P19099 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
AXL P30530 2/20 0.37
MERTK Q12866 2/20 0.37
CTSK P43235 1/20 0.36
KMT2A Q03164 1/20 0.36
KCNH2 Q12809 2/20 0.35
GPR119 Q8TDV5 1/20 0.35
BDKRB1 P46663 1/20 0.35
BACE1 P56817 1/20 0.34
SCN9A Q15858 1/20 0.34
FFAR1 O14842 2/20 0.33
SIRT2 Q8IXJ6 1/20 0.33
SIRT1 Q96EB6 1/20 0.33

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 0.82 HRH3 (0.46) SLC6A2SLC6A4CTSCKCNH2
SCHEMBL4608166 0.81 SLC6A2 (0.42) SLC6A2SLC6A4ALDH1A1KMT2ABACE1
SCHEMBL4608402 0.79 ALDH1A1 (0.38) CTSCCYP11B2ALDH1A1LMNAMAPT
SCHEMBL4606553 0.79 SLC6A2 (0.61) SLC6A2SLC6A4LMNASMN1; SMN2FFAR1
SCHEMBL4607031 0.77 HRH3 (0.49) CTSCKCNH2
SCHEMBL4607106 0.74 SLC6A4 (0.43) SLC6A2SLC6A4SIRT2SIRT1HDAC1
SCHEMBL4604971 0.74 SLC6A2 (0.52) SLC6A2SLC6A4MAPT
SCHEMBL4608244 0.74 SIRT2 (0.40) SLC6A2SLC6A4SIRT2SIRT1
SCHEMBL4607805 0.73 GRIA4 (0.41) SLC6A2SLC6A4ALDH1A1SCN9A
SCHEMBL4606990 0.72 ALDH1A1 (0.49) SLC6A2SLC6A4ALDH1A1FFAR1SIRT2

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