SCHEMBL6685010

SCHEMBL6685010

COc1ccc(Br)cc1N1CC(=O)NS1(=O)=O

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 7/20 0.67
PTPN2 P17706 2/20 0.46
GAA P10253 2/20 0.40
KDM4E B2RXH2 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
GFER P55789 1/20 0.37
P2RX7 Q99572 1/20 0.36
GHSR Q92847 1/20 0.35
HTR6 P50406 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL6687346 0.99 PTPN1 (0.66) PTPN1PTPN2GAAKDM4ETDP1
SCHEMBL6687344 0.97 PTPN1 (0.65) PTPN1PTPN2GAAKDM4ETDP1
SCHEMBL6684915 0.84 PTPN1 (0.67) PTPN1PTPN2KDM4EALDH1A1MEN1
SCHEMBL6688145 0.81 PTPN1 (0.63) PTPN1PTPN2
SCHEMBL17898476 0.81 PTPN1 (1.00) PTPN1PTPN2MEN1KMT2AHTR6
SCHEMBL4643306 0.79 PTPN1 (0.53) PTPN1PTPN2ALDH1A1
SCHEMBL4646374 0.79 PTPN1 (0.60) PTPN1PTPN2
SCHEMBL6841900 0.79 PTPN1 (0.71) PTPN1PTPN2
SCHEMBL1732384 0.77 PTPN1 (0.64) PTPN1PTPN2GAAKDM4EALDH1A1
SCHEMBL17902653 0.77 GAA (0.41) PTPN1GAAKDM4ETDP1ALDH1A1

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