SCHEMBL16561826

SCHEMBL16561826

NC(N)Cc1cnc(P(=O)(O)O)cn1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 1/20 0.31
▸ LAP3 P28838 3/20 0.30
▸ ANPEP P15144 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
SCHEMBL17933360 0.86 ALDH1A1 (0.32) FDPS
SCHEMBL20379780 0.76 CA2 (0.33) —
SCHEMBL16561817 0.74 FDPS (0.40) FDPSLAP3ANPEP
SCHEMBL16561825 0.74 — —
SCHEMBL17933358 0.65 ALDH1A1 (0.31) FDPS
SCHEMBL16561821 0.64 FDPS (0.32) FDPSLAP3ANPEP
SCHEMBL16561819 0.63 FBP1 (0.34) —
SCHEMBL17936302 0.62 SLC7A5 (0.39) —
SCHEMBL17936294 0.62 SLC7A5 (0.39) —
SCHEMBL17933370 0.61 FDPS (0.38) FDPSLAP3ANPEP

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-20160207948-A1 PHOSPHOHISTIDINE AND PHOSPHOTYROSINE ANALOGUES UNIVERSITY OF SHEFFIELD (GB) 2016-07-21 — — US disclosed
WO-2015033120-A1 PHOSPHOHISTIDINE AND PHOSPHOTYROSINE ANALOGUES UNIVERSITY OF SHEFFIELD (GB) 2015-03-12 — — WO 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-20160207948-A1 PHOSPHOHISTIDINE AND PHOSPHOTYROSINE ANALOGUES HRH3, CYTH3, CYTH2 FDPS 3192/4885LAP3 1664/4885ANPEP 124/4885

“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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