SCHEMBL17600488

SCHEMBL17600488

O=C(NC(=O)c1ccccc1)O[C@H]1CO[C@H]2[C@@H]1OC[C@H]2OC(=O)NC(=O)c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BCHE P06276 20/20 0.66

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
SCHEMBL16293726 1.00 BCHE (0.66) BCHE
SCHEMBL21574420 0.80 BCHE (0.78) BCHE
SCHEMBL15845097 0.80 BCHE (0.78) BCHE
SCHEMBL7145226 0.80 BCHE (0.78) BCHE
SCHEMBL4570654 0.80 BCHE (0.78) BCHE
SCHEMBL636806 0.80 BCHE (0.78) BCHE
SCHEMBL27891402 0.75 BCHE (0.73) BCHE
SCHEMBL13454536 0.74 BCHE (0.72) BCHE
SCHEMBL18631352 0.74 BCHE (0.68) BCHE
SCHEMBL4382472 0.74 BCHE (0.68) BCHE

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-9422304-B2 Synthesis of isohexide dicarbamates and derivatives thereof ARCHER DANIELS MIDLAND COMPANY (US) 2016-08-23 US disclosed
US-20160083396-A1 SYNTHESIS OF ISOHEXIDE DICARBAMATES AND DERIVATIVES THEREOF ARCHER DANIELS MIDLAND CO (US) 2016-03-24 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-20160083396-A1 SYNTHESIS OF ISOHEXIDE DICARBAMATES AND DERIVATIVES THEREOF PRKCA, PRKCE, PRKCI BCHE 1011/4885

“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.