SCHEMBL315153

SCHEMBL315153

Cc1cncc(-c2ccc(O[C@H]3SC[C@@H](O)[C@H](O)[C@H]3O)cn2)c1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.35
CYP11B1 P15538 3/20 0.32
CYP11B2 P19099 3/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2A6 P11509 2/20 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
SCHEMBL315152 1.00 CHRNA7 (0.35) CHRNA7CYP11B1CYP11B2CYP3A4CYP2A6
SCHEMBL315275 0.88 FYN (0.37) CYP11B1CYP11B2CYP3A4
SCHEMBL315274 0.88 FYN (0.37) CYP11B1CYP11B2CYP3A4
SCHEMBL316907 0.87 GRM5 (0.32)
SCHEMBL315375 0.87 ABL1 (0.33) CYP11B1CYP11B2
SCHEMBL315374 0.87 ABL1 (0.33) CYP11B1CYP11B2
SCHEMBL316906 0.87 GRM5 (0.32)
SCHEMBL315116 0.87 CYP3A4 (0.36) CHRNA7CYP3A4CYP2A6
SCHEMBL315115 0.87 CYP3A4 (0.36) CHRNA7CYP3A4CYP2A6
SCHEMBL2140810 0.86 CHRNA7 (0.47) CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8093394-B2 Derivatives of 5-thioxylopyranose and use of same for treatment LABORATOIRES FOURNIER S.A. (FR) 2012-01-10 US disclosed
EP-2066683-B1 DERIVATIVES OF 5-THIOXYLOPYRANOSE AND USE OF SAME FOR TREATMENT FOURNIER LAB SA (FR) 2010-11-03 EP disclosed
US-20090182013-A1 Derivatives of 5-Thioxylopyranose and Use of Same for Treatment LABORATOIRES FOURNIER S.A. (FR) 2009-07-16 US 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-20090182013-A1 Derivatives of 5-Thioxylopyranose and Use of Same for Treatment TPMT, PNPO, PPOX CHRNA7 4780/4885CYP11B1 295/4885CYP11B2 261/4885

“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.