SCHEMBL7533516

SCHEMBL7533516

O=C(Nc1cccc(Cl)c1)c1sccc1NS(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
KAT6A Q92794 2/20 0.49
MEN1 O00255 6/20 0.48
KMT2A Q03164 6/20 0.48
LMNA P02545 3/20 0.48
MAPT P10636 3/20 0.48
RECQL P46063 1/20 0.48
ACLY P53396 1/20 0.47
NPSR1 Q6W5P4 2/20 0.47
ALOX12 P18054 1/20 0.47
IDH2 P48735 1/20 0.46
GPR27 Q9NS67 3/20 0.46
PTBP1 P26599 1/20 0.45
ALDH1A1 P00352 2/20 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
SCHEMBL7533623 0.88 ACLY (0.55) HTTL3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL7533670 0.88 HTT (0.52) HTTL3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL7534822 0.87 HTT (0.51) HTTL3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL7534436 0.86 LMNA (0.60) HTTL3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL7531893 0.86 HTT (0.50) HTTL3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL7534376 0.85 L3MBTL1 (0.52) HTTL3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL7533934 0.85 HTT (0.52) HTTL3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL7534407 0.85 LMNA (0.56) MEN1KMT2ALMNAMAPTACLY
SCHEMBL7534240 0.85 MEN1 (0.59) HTTL3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL7537394 0.84 SLC10A2 (0.53) HTTL3MBTL1CYP1A2CYP3A4CYP2D6

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-2002028353-A2 PHOSPHATE TRANSPORT INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2002-04-11 WO claimed
WO-2002028353-A2 PHOSPHATE TRANSPORT INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2002-04-11 WO disclosed