SCHEMBL13802996

SCHEMBL13802996

CC(=O)Nc1nc(N)c(/N=N/c2cc3c(S(=O)(=O)O)cc(SOOO)cc3cc2S(=O)(=O)O)c(C)c1C#N

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 1/20 0.34
▸ CA2 P00918 1/20 0.32
▸ CA3 P07451 1/20 0.32
▸ ENPP2 Q13822 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
SCHEMBL13802986 0.89 PTPN11 (0.38) PTPN11ENPP2
SCHEMBL13814127 0.86 CD40 (0.37) CA2CA3ENPP2
SCHEMBL13802991 0.80 PTPN11 (0.39) PTPN11ENPP2
SCHEMBL13802882 0.76 PTPN11 (0.41) PTPN11
SCHEMBL13814015 0.73 SENP2 (0.39) ENPP2
SCHEMBL14355359 0.71 PTPN11 (0.37) PTPN11CA2CA3ENPP2
SCHEMBL14269778 0.71 PTPN11 (0.34) PTPN11CA2CA3ENPP2
SCHEMBL13425391 0.71 PTPN11 (0.37) PTPN11CA2CA3ENPP2
SCHEMBL13949390 0.69 PTPN11 (0.40) PTPN11CA2CA3ENPP2
SCHEMBL13292128 0.68 PTPN11 (0.36) PTPN11ENPP2

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-20090142554-A1 Yellow Azo Dyes for Ink Jet Printing FUJIFILM IMAGING COLORANTS LIMITED (GB) 2009-06-04 — — 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-20090142554-A1 Yellow Azo Dyes for Ink Jet Printing NR4A3, NR4A1, NR2E3 PTPN11 780/4885CA2 3639/4885CA3 1847/4885

“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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