SCHEMBL7470699

SCHEMBL7470699

CC(C)S(=O)(=O)NCCC1CCC(O)(c2cccs2)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.37
OPRD1 P41143 2/20 0.37
OPRK1 P41145 2/20 0.37
OPRL1 P41146 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SLC6A4 P31645 1/20 0.36
CCR2 P41597 1/20 0.35
KCNH2 Q12809 1/20 0.35
KDM1A O60341 1/20 0.34
NPY5R Q15761 5/20 0.34
GRIA4 P48058 1/20 0.34
KMT2A Q03164 1/20 0.33
SLC6A3 Q01959 1/20 0.33
SIGMAR1 Q99720 1/20 0.32
CCR1 P32246 1/20 0.32
TP53 P04637 2/20 0.32
HTT P42858 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL7461513 0.82 OPRM1 (0.36) OPRM1OPRD1OPRK1OPRL1SLC6A4
SCHEMBL7478542 0.82 GRIA2 (0.44) OPRM1OPRD1OPRK1OPRL1SLC6A4
SCHEMBL24500908 0.71 GRIA1 (0.54) KDM1ANPY5RGRIA4
SCHEMBL6565156 0.71 GRIA1 (0.54) KDM1ANPY5RGRIA4
SCHEMBL7472696 0.70 GRIA2 (0.37) NPC1RAB9AL3MBTL1KDM1ANPY5R
SCHEMBL8393459 0.68 GRIA1 (0.50) KDM1AGRIA4KMT2ASIGMAR1
SCHEMBL7472680 0.67 GRIA1 (0.40) GRIA4KMT2ALMNATSHR
SCHEMBL7469496 0.66 GRIA1 (0.44) KDM1ANPY5RGRIA4
SCHEMBL1308581 0.66
SCHEMBL9879131 0.66 GAA (0.36) NPY5RTSHR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0937708-B1 Sulphonamide derivatives LILLY CO ELI (US) 2002-12-18 EP disclosed
US-6362230-B1 ALZHEIMER'S DISEASE ELI LILLY AND COMPANY 2002-03-26 US disclosed
WO-1999043285-A2 SULPHONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 1999-09-02 WO disclosed
EP-0937708-A2 sulphonamide derivatives ELI LILLY AND COMPANY (US) 1999-08-25 EP disclosed