SCHEMBL4530195

SCHEMBL4530195

Cc1ccccc1S(=O)(=O)N1CCCC1CNC(=O)N[C]1CCCCCCC1.[CH2].[CH2]

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL4537066 0.88 FAAH (0.42)
SCHEMBL4541794 0.87 HSD11B1 (0.54)
SCHEMBL4537325 0.86 MEN1 (0.51) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL4542349 0.85 RAB9A (0.54) RAB9AL3MBTL1
SCHEMBL4541740 0.85 HCRTR1 (0.51) MEN1KMT2AL3MBTL1
SCHEMBL4534767 0.85 FAAH (0.41) MEN1KMT2AL3MBTL1
SCHEMBL4539833 0.84 HSD11B1 (0.53)
SCHEMBL4533514 0.84 ALDH1A1 (0.53) MEN1KMT2AL3MBTL1
SCHEMBL4533525 0.83 KMT2A (0.48) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL4537198 0.82 HTR1A (0.52) RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009070497-A1 SEH AND 11 β-HSD1 INHIBITORS AND THEIR USE SMITHKLINE BEECHAM CORPORATION (US) 2009-06-04 WO claimed
WO-2009070497-A1 SEH AND 11 β-HSD1 INHIBITORS AND THEIR USE SMITHKLINE BEECHAM CORPORATION (US) 2009-06-04 WO disclosed