SCHEMBL313954

SCHEMBL313954

Cc1noc(C)c1-c1cncc(O[C@@H]2SC[C@@H](O)[C@H](O)[C@H]2O)c1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 18/20 0.37
CREBBP Q92793 7/20 0.36
BRD2 P25440 6/20 0.36
FFAR1 O14842 1/20 0.35
ERN1 O75460 1/20 0.33

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
SCHEMBL313955 1.00 BRD4 (0.37) BRD4CREBBPBRD2FFAR1ERN1
SCHEMBL2410464 0.85 BRD4 (0.51) BRD4CREBBPBRD2FFAR1
SCHEMBL2410469 0.85 BRD4 (0.51) BRD4CREBBPBRD2FFAR1
SCHEMBL2412534 0.84 SLC9A3 (0.42) BRD4CREBBPBRD2ERN1
SCHEMBL2412532 0.84 SLC9A3 (0.42) BRD4CREBBPBRD2ERN1
SCHEMBL315584 0.81 CYP11B1 (0.32) BRD4
SCHEMBL315585 0.81 CYP11B1 (0.32) BRD4
SCHEMBL315538 0.81 FFAR1 (0.33) BRD4CREBBPFFAR1ERN1
SCHEMBL315537 0.81 FFAR1 (0.33) BRD4CREBBPFFAR1ERN1
SCHEMBL314591 0.80 MKNK1 (0.38) BRD4

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 5 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
EP-2066683-A1 DERIVATIVES OF 5-THIOXYLOPYRANOSE AND USE OF SAME FOR TREATMENT LABORATOIRES FOURNIER SA (FR) 2009-06-10 EP disclosed
WO-2008037922-A1 DERIVATIVES OF 5-THIOXYLOPYRANOSE AND USE OF SAME FOR TREATMENT 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-20090182013-A1 Derivatives of 5-Thioxylopyranose and Use of Same for Treatment TPMT, PNPO, PPOX BRD4 3810/4885CREBBP 4455/4885BRD2 4694/4885

“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.