SCHEMBL17933345

SCHEMBL17933345

CC(=O)[C@@H](N)Cc1cc(P(=O)(O)O)ccn1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 2/20 0.38
▸ CYP1A2 P05177 1/20 0.33
▸ PRKCI P41743 1/20 0.33
▸ PTPRA P18433 1/20 0.32
▸ PGK1 P00558 1/20 0.32
▸ PGK2 P07205 1/20 0.32
▸ PTPRC P08575 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ DPP4 P27487 1/20 0.31
▸ CIT O14578 1/20 0.31

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
SCHEMBL17933365 1.00 FDPS (0.38) FDPSCYP1A2PRKCIPTPRAPGK1
SCHEMBL16553774 0.87 CYP1A2 (0.47) CYP1A2PTPRCHSD17B10
SCHEMBL17936273 0.87 CYP1A2 (0.47) CYP1A2PTPRCHSD17B10
SCHEMBL17933334 0.78 FDPS (0.36) FDPSCYP1A2PTPRCHSD17B10
SCHEMBL17933353 0.77 CYP1A2 (0.36) CYP1A2HSD17B10
SCHEMBL16131656 0.75 PTPRA (0.56) FDPSCYP1A2PTPRADPP4
SCHEMBL26426462 0.75 PTPRA (0.56) FDPSCYP1A2PTPRADPP4
SCHEMBL12665824 0.75 PTPRA (0.56) FDPSCYP1A2PTPRADPP4
SCHEMBL17656768 0.73 PTPRC (0.46) PTPRCHSD17B10
SCHEMBL17933339 0.73 PTPRC (0.31) PTPRCHSD17B10

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-20160207948-A1 PHOSPHOHISTIDINE AND PHOSPHOTYROSINE ANALOGUES UNIVERSITY OF SHEFFIELD (GB) 2016-07-21 — — 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-20160207948-A1 PHOSPHOHISTIDINE AND PHOSPHOTYROSINE ANALOGUES HRH3, CYTH3, CYTH2 FDPS 3192/4885CYP1A2 4128/4885PRKCI 1125/4885

“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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