SCHEMBL7537394

SCHEMBL7537394

O=C(Nc1cccc(Cl)c1)c1sccc1NS(=O)(=O)c1cccc(F)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC10A2 Q12908 1/20 0.53
SLC10A1 Q14973 1/20 0.53
SLC10A6 Q3KNW5 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.51
HTT P42858 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
ATM Q13315 1/20 0.48
LMNA P02545 5/20 0.48
PTBP1 P26599 1/20 0.48
ACLY P53396 1/20 0.48
MEN1 O00255 7/20 0.48
KMT2A Q03164 7/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
HPGD P15428 2/20 0.48
ALOX12 P18054 1/20 0.48

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
SCHEMBL7538739 0.96 MEN1 (0.49) SLC10A2SLC10A1SLC10A6L3MBTL1HTT
SCHEMBL7538848 0.93 ACLY (0.52) SLC10A2SLC10A1SLC10A6L3MBTL1HTT
SCHEMBL7534376 0.91 L3MBTL1 (0.52) L3MBTL1HTTCYP1A2CYP3A4CYP2D6
SCHEMBL7534822 0.90 HTT (0.51) L3MBTL1HTTCYP1A2CYP3A4CYP2D6
SCHEMBL7533623 0.89 ACLY (0.55) L3MBTL1HTTCYP1A2CYP3A4CYP2D6
SCHEMBL7531893 0.89 HTT (0.50) L3MBTL1HTTCYP1A2CYP3A4CYP2D6
SCHEMBL7531845 0.87 HTT (0.47) L3MBTL1HTTCYP1A2CYP3A4CYP2D6
SCHEMBL7532778 0.87 SLC20A2 (0.54) L3MBTL1HTTCYP1A2CYP3A4CYP2D6
SCHEMBL7531372 0.86 SLC10A2 (0.48) SLC10A2SLC10A1SLC10A6ATMACLY
SCHEMBL7533670 0.86 HTT (0.52) L3MBTL1HTTCYP1A2CYP3A4CYP2D6

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