SCHEMBL7533592

SCHEMBL7533592

O=C(Nc1nccc2ccccc12)c1sccc1NS(=O)(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 2/20 0.46
METAP1 P53582 2/20 0.46
RECQL P46063 2/20 0.45
SLC40A1 Q9NP59 6/20 0.43
HTR1A P08908 1/20 0.42
HTR2A P28223 1/20 0.42
HTR7 P34969 1/20 0.42
HTR6 P50406 1/20 0.42
GRM4 Q14833 1/20 0.41
KMT2A Q03164 5/20 0.41
MEN1 O00255 3/20 0.41
ACLY P53396 1/20 0.41
TDP1 Q9NUW8 2/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
G6PD P11413 1/20 0.41
NFKBIA P25963 1/20 0.41
AGTR1 P30556 1/20 0.41
GLO1 Q04760 1/20 0.41
PAX8 Q06710 1/20 0.41

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
SCHEMBL7537224 0.97 ACLY (0.47) METAP2METAP1RECQLSLC40A1HTR1A
SCHEMBL7531707 0.83 RECQL (0.60) METAP2METAP1RECQLKMT2AMEN1
SCHEMBL7531142 0.80 POLB (0.59) METAP2METAP1KMT2AMEN1TDP1
SCHEMBL7531709 0.79 SLC40A1 (0.65) METAP2METAP1SLC40A1KMT2AMEN1
SCHEMBL3168431 0.78 SCN3A (0.61) RECQLKMT2AMEN1TDP1ALDH1A1
SCHEMBL7531380 0.78 HTT (0.52) KMT2AMEN1TDP1ALDH1A1MAPT
SCHEMBL7531704 0.78 ALDH1A1 (0.57) RECQLGRM4KMT2AMEN1ACLY
SCHEMBL7530687 0.77 HTT (0.48) METAP2METAP1RECQLSLC40A1KMT2A
SCHEMBL7530791 0.77 POLB (0.56) METAP2METAP1KMT2AMEN1ACLY
SCHEMBL7533688 0.76 PABPC1 (0.56) METAP2METAP1RECQLSLC40A1GRM4

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