SCHEMBL13167166

SCHEMBL13167166

N=C(N)c1ccc2nc(-c3ccc(-c4ccc(C(=N)N)c(F)c4)o3)[nH]c2c1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLAU P00749 9/20 0.53
PRSS1 P07477 5/20 0.53
PLG P00747 8/20 0.52
F2 P00734 5/20 0.52
F10 P00742 5/20 0.52
PLAT P00750 4/20 0.52
F7 P08709 1/20 0.51
HDAC6 Q9UBN7 1/20 0.49
HPN P05981 1/20 0.47
PRSS2 P07478 1/20 0.47
PRSS3 P35030 1/20 0.47

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
SCHEMBL12348382 0.86 PLAU (0.62) PLAUPRSS1PLGF2F10
SCHEMBL5408978 0.85 PLAU (0.65) PLAUPRSS1PLGF2F10
SCHEMBL13167141 0.85 PLAU (0.62) PLAUPRSS1PLGF2F10
SCHEMBL29699362 0.85 F2 (0.68) PLAUPRSS1PLGF2F10
SCHEMBL14259601 0.85 F2 (0.68) PLAUPRSS1PLGF2F10
SCHEMBL13882980 0.79 PLAU (0.55) PLAUPRSS1PLGF2F10
SCHEMBL13167152 0.78 F2 (0.59) PLAUPRSS1PLGF2F10
SCHEMBL14599560 0.78 PLAU (0.63) PLAUPRSS1PLGF2F10
SCHEMBL5408990 0.77 PLAU (0.52) PLAUPRSS1PLGF2F10
SCHEMBL14519390 0.76 PLAU (0.86) PLAUPRSS1PLGF2F10

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100249175-A1 Dicationic compounds which selectively recognize G-quadruplex DNA GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2010-09-30 US disclosed
US-20100249175-A1 Dicationic compounds which selectively recognize G-quadruplex DNA GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2010-09-30 US disclosed
EP-1792613-A2 Dicationic compounds which selectively recognize G-quadruplex DNA UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2007-06-06 EP 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-20100249175-A1 Dicationic compounds which selectively recognize G-quadruplex DNA DDB1, DNA2, SSBP1 PLAU 4677/4885PRSS1 4661/4885PLG 3752/4885

“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.