SCHEMBL2415119

SCHEMBL2415119

CC(=O)O[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)CS[C@H]1Oc1ccc(Br)cc1F

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN2 P17706 3/20 0.33
PTPN1 P18031 3/20 0.33
PTPN6 P29350 1/20 0.33
FPR2 P25090 1/20 0.32
PROKR1 Q8TCW9 1/20 0.32
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
PKM P14618 1/20 0.31
AAK1 Q2M2I8 2/20 0.31
PTPRF P10586 1/20 0.31
DGAT1 O75907 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
HTT P42858 1/20 0.31
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL2415123 1.00 PTPN2 (0.33) PTPN2PTPN1PTPN6FPR2PROKR1
SCHEMBL2410710 0.91 PTPN2 (0.33) PTPN2PTPN1PTPN6PTPRF
SCHEMBL2410712 0.91 PTPN2 (0.33) PTPN2PTPN1PTPN6PTPRF
SCHEMBL2411455 0.86
SCHEMBL2411451 0.86
SCHEMBL2407694 0.84 PTPN2 (0.33) PTPN2PTPN1PTPN6POLBPTPRF
SCHEMBL2407692 0.84 PTPN2 (0.33) PTPN2PTPN1PTPN6POLBPTPRF
SCHEMBL2417235 0.82 CYP17A1 (0.37) AAK1
SCHEMBL2417231 0.82 CYP17A1 (0.37) AAK1
SCHEMBL2408844 0.82 PIN1 (0.35) PTPN2PTPN1PTPN6

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8013010-B2 5-thioxylopyranose compounds LABORATOIRES FOURNIER S.A. (FR) 2011-09-06 US disclosed
US-20090186840-A1 5-Thioxylopyranose Compounds LABORATOIRES FOURNIER S.A (FR) 2009-07-23 US disclosed
EP-2066681-A1 NEW DERIVATIVES OF 5-THIOXILOPYRANOSE LABORATOIRES FOURNIER SA (FR) 2009-06-10 EP disclosed
WO-2008037923-A1 NEW DERIVATIVES OF 5-THIOXILOPYRANOSE LABORATOIRES FOURNIER S.A. (FR) 2008-04-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090186840-A1 5-Thioxylopyranose Compounds TPMT, PNPO, CYP3A5 PTPN2 509/4885PTPN1 379/4885PTPN6 382/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.