SCHEMBL7103572

SCHEMBL7103572

OC[C@H]1O[C@H](OC[C@@H](O)[C@@H](O)[C@H](O)c2cnc3ccccc3n2)[C@H](O)[C@@H](O)[C@H]1O

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CD209 Q9NNX6 3/20 0.42
PTPN1 P18031 1/20 0.37

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
SCHEMBL7105467 1.00 CD209 (0.42) CD209PTPN1
SCHEMBL7104955 0.86 CD209 (0.39) CD209
SCHEMBL7106637 0.82 CD209 (0.44) CD209
SCHEMBL7106557 0.82 CD209 (0.44) CD209
SCHEMBL7153515 0.74 GAA (0.50)
SCHEMBL21245904 0.74 GAA (0.50)
SCHEMBL1782151 0.74 GAA (0.50)
SCHEMBL21245905 0.74 GAA (0.50)
SCHEMBL12604144 0.74 GAA (0.50)
SCHEMBL1782020 0.74 GAA (0.50)

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-20030207886-A1 Preparation containing quinoxaline derivatives MERCK PATENT GMBH (DE) 2003-11-06 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-20030207886-A1 Preparation containing quinoxaline derivatives CUTA, XPA, NQO2 CD209 4472/4885PTPN1 3134/4885

“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.