SCHEMBL6183547

SCHEMBL6183547

Cc1cc(S(=O)(=O)N2CCN(C(=O)C3CCN(c4ccncc4)CC3)CC2)cc(C)c1F

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LSS P48449 3/20 0.70
F10 P00742 1/20 0.64
CHRM1 P11229 8/20 0.59
NPC1 O15118 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.52
CNR1 P21554 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
HTT P42858 1/20 0.50
MAPT P10636 1/20 0.50
MAPK1 P28482 1/20 0.50

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
SCHEMBL6180061 0.85 LSS (0.80) LSSF10CHRM1L3MBTL1CNR1
SCHEMBL6786388 0.82 LSS (0.76) LSSF10CHRM1NPC1L3MBTL1
SCHEMBL7401658 0.81 LSS (1.00) LSSF10CHRM1L3MBTL1CNR1
SCHEMBL1387210 0.80 F10 (0.82) LSSF10CHRM1SMN1; SMN2MAPK1
SCHEMBL1387298 0.79 LSS (0.88) LSSF10CHRM1NPC1CNR1
SCHEMBL6794182 0.79 F10 (0.80) LSSF10CHRM1MAPK1
SCHEMBL6792931 0.79 F10 (0.76) LSSF10CHRM1L3MBTL1SMN1; SMN2
SCHEMBL6181000 0.78 LSS (0.76) LSSF10CHRM1L3MBTL1CNR1
SCHEMBL1387276 0.78 LSS (0.94) LSSF10CHRM1L3MBTL1CNR1
SCHEMBL1387325 0.78 F10 (0.77) LSSF10CHRM1CNR1SMN1; SMN2

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-0844877-B1 USE OF OXIDO-SQUALENE CYCLASE INHIBITORS TO LOWER BLOOD CHOLESTEROL ASTRAZENECA AB (SE) 2005-01-26 EP disclosed
US-6090813-A Use of oxido-squalene cyclase inhibitors to lower blood cholesterol ZENECA LIMITED (GB) 2000-07-18 US disclosed
EP-0844877-A1 USE OF OXIDO-SQUALENE CYCLASE INHIBITORS TO LOWER BLOOD CHOLESTEROL ZENECA LIMITED (GB) 1998-06-03 EP disclosed
WO-1997006802-A1 USE OF OXIDO-SQUALENE CYCLASE INHIBITORS TO LOWER BLOOD CHOLESTEROL ZENECA LIMITED (GB) 1997-02-27 WO disclosed