SCHEMBL6683753

SCHEMBL6683753

O=C1CN(c2ccc(Br)cc2)S(=O)(=O)N1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 8/20 0.69
PTPN2 P17706 5/20 0.48
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
FAAH O00519 1/20 0.37
MGLL Q99685 1/20 0.37
MMP13 P45452 1/20 0.36
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34
SLC40A1 Q9NP59 1/20 0.33
MMP2 P08253 1/20 0.33
ALKBH5 Q6P6C2 1/20 0.32

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
SCHEMBL4224258 0.82 PTPN1 (0.69) PTPN1PTPN2MEN1KMT2APOLB
SCHEMBL1730640 0.82 PTPN1 (0.69) PTPN1PTPN2FAAHMGLLSLC40A1
SCHEMBL1688165 0.82 PTPN1 (0.69) PTPN1PTPN2MEN1KMT2AMGLL
SCHEMBL1732116 0.81 PTPN1 (1.00) PTPN1PTPN2MEN1KMT2ASLC40A1
SCHEMBL6684475 0.80 PTPN1 (0.66) PTPN1PTPN2MEN1KMT2AMGLL
SCHEMBL1731402 0.80 PTPN1 (0.96) PTPN1PTPN2MEN1KMT2ASLC40A1
SCHEMBL14045280 0.79 PTPN1 (0.65) PTPN1PTPN2SLC40A1
SCHEMBL1732114 0.78 PTPN1 (0.63) PTPN1PTPN2
SCHEMBL4231433 0.78 PTPN1 (0.63) PTPN1MEN1KMT2APOLB
SCHEMBL15158587 0.78 PTPN1 (0.63) PTPN1PTPN2MEN1KMT2AHPGD

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-2004041799-A1 5- (SUBSTITUTED PHENYL) -THIADIAZOLIDINE-3-ONES AND THEIR USE AS PTP1B ASTRAZENECA AB (SE) 2004-05-21 WO disclosed