SCHEMBL10140086

SCHEMBL10140086

N=C(N)c1ccc2nc(C3=C(O)C(c4ccccc4)=NC3)[nH]c2c1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLAU P00749 9/20 0.67
PRSS1 P07477 8/20 0.67
F10 P00742 12/20 0.60
F2 P00734 10/20 0.60
PLG P00747 8/20 0.60
PLAT P00750 8/20 0.60
F9 P00740 3/20 0.60
F7 P08709 4/20 0.58
F11 P03951 2/20 0.58
HPN P05981 1/20 0.57
PRSS2 P07478 1/20 0.57
PRSS3 P35030 1/20 0.57
CHEK2 O96017 2/20 0.54

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
SCHEMBL10140070 0.87 PLAU (0.49) PLAUPRSS1F10F2PLG
SCHEMBL10140089 0.86 PLAU (0.48) PLAUPRSS1F10F2PLG
SCHEMBL10140839 0.81 CHEK2 (0.44) PLAUPRSS1F10F2PLG
SCHEMBL10140363 0.79 CHEK2 (0.41) PLAUPRSS1F10F2PLG
SCHEMBL29941983 0.75 F10 (1.00) PLAUPRSS1F10F2PLG
SCHEMBL6292957 0.75 F10 (1.00) PLAUPRSS1F10F2PLG
SCHEMBL7474218 0.75 F10 (0.78) PLAUPRSS1F10F2PLG
SCHEMBL7974196 0.74 CHEK2 (0.55) CHEK2
SCHEMBL14519390 0.74 PLAU (0.86) PLAUPRSS1F10F2PLG
SCHEMBL1232783 0.73 F10 (1.00) PLAUPRSS1F10F2PLG

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-8148363-B2 Heterocyclic compounds as factor IXA inhibitors SCHERING CORPORATION (US) 2012-04-03 US disclosed
US-20110065682-A1 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-03-17 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-20110065682-A1 HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS F9, F12, F8 PLAU 67/4885PRSS1 309/4885F10 11/4885

“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.