SCHEMBL10031321

SCHEMBL10031321

CCOC(=O)OC[C@H]1O[C@H](Oc2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SLC5A1 P13866 3/20 0.63
▸ SLC5A2 P31639 3/20 0.63
▸ CYP2C19 P33261 4/20 0.47
▸ CYP2C9 P11712 3/20 0.47
▸ CYP3A4 P08684 2/20 0.46
▸ MAPT P10636 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ TYR P14679 1/20 0.45
▸ THRB P10828 1/20 0.44

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
SCHEMBL10031325 1.00 SLC5A1 (0.63) SLC5A1SLC5A2CYP2C19CYP2C9CYP3A4
SCHEMBL10031322 0.86 TYR (0.48) SLC5A1SLC5A2ALDH1A1TDP1TYR
SCHEMBL14949166 0.81 CYP2C19 (0.56) SLC5A1SLC5A2CYP2C19CYP2C9CYP3A4
SCHEMBL19189971 0.81 CYP2C19 (0.56) SLC5A1SLC5A2CYP2C19CYP2C9CYP3A4
SCHEMBL4980901 0.80 SLC5A1 (0.61) SLC5A1SLC5A2CYP2C19CYP2C9CYP3A4
SCHEMBL28923022 0.80 SLC5A1 (0.61) SLC5A1SLC5A2CYP2C19CYP2C9CYP3A4
SCHEMBL9221993 0.80 TLR4 (0.51) SLC5A1SLC5A2
SCHEMBL6009966 0.80 TYR (0.52) SLC5A1SLC5A2TYR
SCHEMBL13076920 0.80 CYP2C19 (0.46) SLC5A1SLC5A2CYP2C19CYP2C9CYP3A4
SCHEMBL4351209 0.78 SLC5A2 (0.84) SLC5A1SLC5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120053330-A1 Chemical Process GLAXOSMITHKLINE LLC 2012-03-01 — — US disclosed
US-20120053330-A1 Chemical Process GLAXOSMITHKLINE LLC 2012-03-01 — — 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-20120053330-A1 Chemical Process SLC5A2, SLC5A1, UGGT1 SLC5A1 2/4885SLC5A2 1/4885CYP2C19 157/4885

“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.

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