SCHEMBL2410189

SCHEMBL2410189

O[C@@H]1[C@@H](O)[C@H](Oc2cc(-c3cccnc3)ccc2F)SC[C@H]1O

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 8/20 0.41
MKNK2 Q9HBH9 8/20 0.41
CYP11B1 P15538 3/20 0.38
CYP11B2 P19099 3/20 0.38
CYP1A2 P05177 1/20 0.38
PDK2 Q15119 1/20 0.37
ERN1 O75460 1/20 0.36
ABCB1 P08183 7/20 0.36
ABCC1 P33527 3/20 0.36
CYP19A1 P11511 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
SCHEMBL2410194 1.00 MKNK1 (0.41) MKNK1MKNK2CYP11B1CYP11B2CYP1A2
SCHEMBL2412977 0.91 ABCB1 (0.39) MKNK1MKNK2CYP11B1CYP11B2CYP1A2
SCHEMBL2412970 0.91 ABCB1 (0.39) MKNK1MKNK2CYP11B1CYP11B2CYP1A2
SCHEMBL2412587 0.88 ERN1 (0.38) MKNK1MKNK2CYP11B1CYP11B2ERN1
SCHEMBL2412590 0.88 ERN1 (0.38) MKNK1MKNK2CYP11B1CYP11B2ERN1
SCHEMBL2419641 0.87 MKNK1 (0.41) MKNK1MKNK2CYP11B1CYP11B2CYP1A2
SCHEMBL314886 0.87 CYP11B2 (0.37) MKNK1MKNK2CYP11B1CYP11B2CYP1A2
SCHEMBL314885 0.87 CYP11B2 (0.37) MKNK1MKNK2CYP11B1CYP11B2CYP1A2
SCHEMBL2419644 0.87 MKNK1 (0.41) MKNK1MKNK2CYP11B1CYP11B2CYP1A2
SCHEMBL2409243 0.84 CYP11B1 (0.48) MKNK1MKNK2CYP11B1CYP11B2PDK2

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 MKNK1 2501/4885MKNK2 2929/4885CYP11B1 201/4885

“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.