SCHEMBL6164014

SCHEMBL6164014

N#Cc1ccccc1-c1ccc(NC(=O)c2cccnc2-c2cccc(C(=N)N)c2)cc1

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F10 P00742 18/20 0.72
F2 P00734 13/20 0.72
PRSS1 P07477 11/20 0.72
PRSS2 P07478 11/20 0.72
PRSS3 P35030 11/20 0.72
PLAU P00749 1/20 0.49
PLAT P00750 1/20 0.49
TRPV1 Q8NER1 1/20 0.46

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
SCHEMBL6167429 0.86 F10 (0.53) F10F2PRSS1PRSS2PRSS3
SCHEMBL6164849 0.85 F10 (0.64) F10F2PRSS1PRSS2PRSS3
SCHEMBL7103085 0.84 F10 (0.52) F10F2PRSS1PRSS2PRSS3
SCHEMBL6164000 0.83 F10 (0.85) F10F2PRSS1PRSS2PRSS3
SCHEMBL6164025 0.82 F10 (0.51) F10F2PRSS1PRSS2PRSS3
SCHEMBL6163102 0.81 F10 (0.82) F10F2PRSS1PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL7100867 0.81 F10 (0.57) F10F2PRSS1PRSS2PRSS3
SCHEMBL6185412 0.80 F10 (0.47) F10F2PRSS1PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL7106019 0.80 F10 (0.67) F10F2PRSS1PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL6166035 0.79 F10 (1.00) F10F2PRSS1PRSS2PRSS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1254136-A4 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG CHEM INVESTMENT LTD (KR) 2005-06-01 EP disclosed
US-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof LG CHEM INVESTMENT LTD. (KR) 2003-04-03 US disclosed
EP-1254136-A1 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG Chem Investment, Ltd. (KR) 2002-11-06 EP disclosed
WO-2001055146-A1 FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF LG CHEM INVESTMENT LTD. (KR) 2001-08-02 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-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof F2, F12, TFPI F10 11/4885F2 1/4885PRSS1 43/4885

“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.