SCHEMBL16907857

SCHEMBL16907857

O=C(O)CNC(=O)C(c1nc2ccc(Br)cc2s1)S(=O)(=O)N1CCOCC1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 17/20 0.59
▸ ALDH1A1 P00352 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ CLK1 P49759 1/20 0.47
▸ LIPC P11150 8/20 0.47
▸ LRRK2 Q5S007 1/20 0.44

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
SCHEMBL16907859 0.88 LIPG (0.55) LIPGALDH1A1MAPTHTTCLK1
SCHEMBL16907856 0.88 LIPG (0.76) LIPGLIPC
SCHEMBL16899384 0.81 LIPG (0.57) LIPGLIPC
SCHEMBL16899468 0.79 LIPG (0.56) LIPGLIPC
SCHEMBL20603445 0.75 LIPG (1.00) LIPGLIPC
SCHEMBL15464346 0.74 LIPC (0.76) LIPGLIPC
SCHEMBL18219150 0.73 LIPG (1.00) LIPGLIPC
SCHEMBL20603428 0.72 LIPG (1.00) LIPGLIPC
SCHEMBL18219149 0.72 LIPG (0.76) LIPGLIPC
SCHEMBL19709505 0.72 LIPC (0.56) LIPGLIPC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015105749-A1 SULFONE AMIDE LINKED BENZOTHIAZOLE INHIBITORS OF ENDOTHELIAL LIPASE BRISTOL-MYERS SQUIBB COMPANY (US) 2015-07-16 — — WO disclosed
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