SCHEMBL7531709

SCHEMBL7531709

O=C(Nc1cccc2cccnc12)c1sccc1NS(=O)(=O)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC40A1 Q9NP59 11/20 0.65
TDP1 Q9NUW8 6/20 0.65
GLO1 Q04760 6/20 0.65
AGTR1 P30556 2/20 0.65
NFKBIA P25963 2/20 0.65
G6PD P11413 1/20 0.65
METAP2 P50579 1/20 0.65
METAP1 P53582 1/20 0.65
PAX8 Q06710 1/20 0.65
ATM Q13315 1/20 0.65
KDR P35968 1/20 0.55
MMP2 P08253 1/20 0.54
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 0.52
MITF O75030 1/20 0.52
S1PR4 O95977 1/20 0.52
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
MAPT P10636 1/20 0.52
S1PR1 P21453 1/20 0.52

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
SCHEMBL7531380 0.84 HTT (0.52) TDP1KMT2AMEN1ALDH1A1LMNA
SCHEMBL7531707 0.83 RECQL (0.60) METAP2METAP1MMP2KMT2AMEN1
SCHEMBL7530687 0.81 HTT (0.48) SLC40A1TDP1GLO1AGTR1NFKBIA
SCHEMBL7569455 0.81 KDM4E (0.67) TDP1ATMKMT2AMEN1ALDH1A1
SCHEMBL7533688 0.81 PABPC1 (0.56) SLC40A1TDP1GLO1AGTR1NFKBIA
SCHEMBL442367 0.80 SLC40A1 (1.00) SLC40A1TDP1GLO1AGTR1NFKBIA
SCHEMBL7531142 0.80 POLB (0.59) TDP1METAP2METAP1KMT2AMEN1
SCHEMBL7533592 0.79 METAP2 (0.46) SLC40A1TDP1GLO1AGTR1NFKBIA
SCHEMBL7746129 0.79 SLC40A1 (0.97) SLC40A1TDP1GLO1AGTR1NFKBIA
SCHEMBL7531823 0.78 MAPT (0.55) KMT2AMEN1ALDH1A1LMNAMAPT

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