SCHEMBL6514723

SCHEMBL6514723

CCc1ccc(Cc2ccccc2O[C@H]2O[C@H](C(O)C(C)=O)[C@](O)(C(C)=O)[C@@](O)(C(C)=O)[C@]2(O)C(C)=O)cc1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 13/20 0.38
SLC5A1 P13866 10/20 0.38
HRH1 P35367 5/20 0.32
CYP2D6 P10635 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31

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
SCHEMBL6510862 0.92 SLC5A2 (0.43) SLC5A2SLC5A1HRH1
SCHEMBL9789419 0.77
SCHEMBL27970168 0.72 TSHR (0.33)
SCHEMBL6415287 0.72 SLC5A2 (0.41) SLC5A2SLC5A1
SCHEMBL18259481 0.72
SCHEMBL27863829 0.71 ALDH1A1 (0.35)
SCHEMBL9235203 0.71 SLC1A3 (0.32) CYP2D6
SCHEMBL5974236 0.70 SLC5A2 (0.42) SLC5A2
SCHEMBL1267322 0.70 SLC5A1 (0.32) SLC5A2SLC5A1
SCHEMBL9093991 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050080022-A1 Glucopyranosyloxybenzylbenzene derivatives, medicinal compositions containing the same and intermediates for the preparation of the derivatives KISSEI PHARMACEUTICAL CO., LTD. 2005-04-14 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-20050080022-A1 Glucopyranosyloxybenzylbenzene derivatives, medicinal compositions containing the same and intermediates for the preparation of the derivatives SLC5A2, SLC5A1, SLC2A2 SLC5A2 1/4885SLC5A1 2/4885HRH1 3860/4885

“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.