SCHEMBL7533744

SCHEMBL7533744

COc1ccc(NC(=O)c2sccc2NS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC20A2 Q08357 1/20 0.58
SLC20A1 Q8WUM9 1/20 0.58
CCR2 P41597 1/20 0.48
POLB P06746 2/20 0.46
AVPR2 P30518 1/20 0.45
GPR27 Q9NS67 1/20 0.45
USP2 O75604 1/20 0.45
USP8 P40818 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
ALDH1A1 P00352 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
MAPT P10636 3/20 0.45
HTT P42858 3/20 0.45
NPSR1 Q6W5P4 2/20 0.45
GAA P10253 1/20 0.45
HPGD P15428 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
LMNA P02545 2/20 0.44
KMT2A Q03164 2/20 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
SCHEMBL7537216 0.87 ALDH1A1 (0.58) POLBAVPR2GPR27SMN1; SMN2ALDH1A1
SCHEMBL7530790 0.85 SLC20A2 (0.65) SLC20A2SLC20A1CCR2POLBAVPR2
SCHEMBL7537253 0.85 IDH2 (0.54) SLC20A2SLC20A1CCR2POLBNPC1
SCHEMBL7532778 0.85 SLC20A2 (0.54) SLC20A2SLC20A1CCR2POLBSMN1; SMN2
SCHEMBL7208743 0.84 SLC20A2 (0.70) SLC20A2SLC20A1AVPR2GPR27USP2
SCHEMBL7538011 0.84 LMNA (0.55) POLBAVPR2GPR27SMN1; SMN2ALDH1A1
SCHEMBL7562743 0.84 ACLY (0.52) SLC20A2SLC20A1CCR2AVPR2GPR27
SCHEMBL7538052 0.80 SMN1; SMN2 (0.56) POLBSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL7532056 0.80 SMN1; SMN2 (0.47) POLBSMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL1200684 0.79 PARP14 (0.62) SLC20A2SLC20A1CCR2USP2USP8

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