SCHEMBL17437708

SCHEMBL17437708

N#C[C@H]1CO[C@H]2[C@@H]1OC[C@H]2O

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.59
LMNA P02545 1/20 0.59
MAPT P10636 1/20 0.36
GBA1 P04062 1/20 0.30

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
SCHEMBL17445737 1.00 THRB (0.59) THRBLMNAMAPTGBA1
SCHEMBL15391171 0.85 THRB (0.32) THRBLMNA
SCHEMBL19011892 0.85 THRB (0.32) THRBLMNA
SCHEMBL19011757 0.85 THRB (0.32) THRBLMNA
SCHEMBL803397 0.85 THRB (0.32) THRBLMNA
SCHEMBL804256 0.85 THRB (0.32) THRBLMNA
SCHEMBL15391925 0.85 THRB (0.32) THRBLMNA
SCHEMBL804253 0.85 THRB (0.32) THRBLMNA
Isosorbide SCHEMBL31538807 0.80 THRB (0.93) THRBLMNAMAPT
Isosorbide SCHEMBL24465084 0.77 THRB (1.00) THRBLMNAMAPTGBA1

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-20160016969-A1 ISOHEXIDE MONOTRIFLATES AND PROCESS FOR SYNTHESIS THEREOF ARCHER DANIELS MIDLAND COMPANY (US) 2016-01-21 US disclosed
US-20160016969-A1 ISOHEXIDE MONOTRIFLATES AND PROCESS FOR SYNTHESIS THEREOF ARCHER DANIELS MIDLAND COMPANY (US) 2016-01-21 US disclosed
US-20160016969-A1 ISOHEXIDE MONOTRIFLATES AND PROCESS FOR SYNTHESIS THEREOF ARCHER DANIELS MIDLAND COMPANY (US) 2016-01-21 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-20160016969-A1 ISOHEXIDE MONOTRIFLATES AND PROCESS FOR SYNTHESIS THEREOF PPIP5K2, TALDO1, MSH2 THRB 3354/4885LMNA 1370/4885MAPT 2573/4885

“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.