SCHEMBL2409275

SCHEMBL2409275

O[C@@H]1[C@@H](O)[C@H](Oc2cccc(-c3cncc(Cl)c3)c2)SC[C@H]1O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.35
KCNH2 Q12809 1/20 0.35
BACE2 Q9Y5Z0 1/20 0.35
XDH P47989 1/20 0.34
SLC22A12 Q96S37 1/20 0.34
FPR2 P25090 1/20 0.33
MKNK1 Q9BUB5 1/20 0.33
MKNK2 Q9HBH9 1/20 0.33
FGFR1 P11362 1/20 0.32
ADORA3 P0DMS8 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
SCHEMBL2409280 1.00 BACE1 (0.35) BACE1KCNH2BACE2XDHSLC22A12
SCHEMBL315872 0.89 CHRNB2 (0.36) MKNK1MKNK2FGFR1
SCHEMBL315871 0.89 CHRNB2 (0.36) MKNK1MKNK2FGFR1
SCHEMBL2417047 0.86 S1PR1 (0.39) BACE1BACE2XDHSLC22A12FPR2
SCHEMBL2411961 0.86 CYP11B1 (0.41) BACE1BACE2MKNK1MKNK2
SCHEMBL2411825 0.86 PRMT5 (0.39) BACE1BACE2FPR2
SCHEMBL2411967 0.86 CYP11B1 (0.41) BACE1BACE2MKNK1MKNK2
SCHEMBL2417043 0.86 S1PR1 (0.39) BACE1BACE2XDHSLC22A12FPR2
SCHEMBL2411823 0.86 PRMT5 (0.39) BACE1BACE2FPR2
SCHEMBL2410200 0.86 PRMT5 (0.35) BACE1KCNH2FPR2ADORA3

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 BACE1 3683/4885KCNH2 3664/4885BACE2 4067/4885

“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.