SCHEMBL18949552

SCHEMBL18949552

CC(=O)O[C@H]1C[C@H](O[C@H]2[C@@H](O)C[C@H](O[C@H]3[C@@H](O)C[C@@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5C[C@@H](O)[C@]5(C)[C@@H](C7=CC(=O)OC7)CC[C@]65O)C4)O[C@@H]3C)O[C@@H]2N)O[C@H](C)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.94

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PAX8 Q06710 3/20 0.94
▸ LMNA P02545 3/20 0.94
▸ TP53 P04637 3/20 0.94
▸ SMN1; SMN2 Q16637 3/20 0.94
▸ THRB P10828 1/20 0.94
▸ MAPT P10636 1/20 0.83
▸ ATP1A1 P05023 12/20 0.67
▸ ATP1B1 P05026 12/20 0.67
▸ ATP1A2 P50993 12/20 0.67
▸ ATP1B2 P14415 11/20 0.67
▸ ATP1B3 P54709 11/20 0.67
▸ NPC1 O15118 2/20 0.67
▸ RAB9A P51151 2/20 0.67
▸ GLA P06280 1/20 0.67
▸ ATP1A3 P13637 1/20 0.67
▸ STAT3 P40763 1/20 0.67
▸ RECQL P46063 1/20 0.67
▸ RORC P51449 1/20 0.67
▸ FXYD2 P54710 1/20 0.67
▸ ATP1A4 Q13733 1/20 0.67

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
Lanatoside C SCHEMBL18277653 0.97 PAX8 (1.00) PAX8LMNATP53SMN1; SMN2THRB
Lanatoside C SCHEMBL18223891 0.97 PAX8 (1.00) PAX8LMNATP53SMN1; SMN2THRB
Lanatoside C SCHEMBL20582682 0.97 PAX8 (1.00) PAX8LMNATP53SMN1; SMN2THRB
Lanatoside C SCHEMBL18364709 0.97 PAX8 (1.00) PAX8LMNATP53SMN1; SMN2THRB
Lanatoside C SCHEMBL44110 0.97 PAX8 (1.00) PAX8LMNATP53SMN1; SMN2THRB
Lanatoside C SCHEMBL23054706 0.97 PAX8 (1.00) PAX8LMNATP53SMN1; SMN2THRB
Lanatoside C SCHEMBL18947801 0.97 PAX8 (1.00) PAX8LMNATP53SMN1; SMN2THRB
Lanatoside C SCHEMBL15959375 0.97 PAX8 (1.00) PAX8LMNATP53SMN1; SMN2THRB
SCHEMBL24837992 0.94 PAX8 (0.94) PAX8LMNATP53SMN1; SMN2THRB
SCHEMBL20251039 0.94 PAX8 (0.94) PAX8LMNATP53SMN1; SMN2THRB

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-20200140500-A1 HIGH THROUGHPUT METHODS, PROTEIN INHIBITORS, AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2020-05-07 — — US disclosed
US-9675623-B2 Non-surgical method of treatment for cataract THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2017-06-13 — — 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-20200140500-A1 HIGH THROUGHPUT METHODS, PROTEIN INHIBITORS, AND USES THEREOF HSF1, HSP90B1, HSPH1 PAX8 4730/4885LMNA 3845/4885TP53 707/4885

“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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