SCHEMBL7107211

SCHEMBL7107211

CCOC(=O)c1csc(C(Cc2cccc(C(=N)N)c2)(NC(=O)c2ccc(-c3ccccc3S(N)(=O)=O)cc2)OC(=O)C(F)(F)F)n1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 16/20 0.44
F10 P00742 15/20 0.44
PRSS2 P07478 14/20 0.44
PRSS3 P35030 14/20 0.44
F2 P00734 12/20 0.44
PLG P00747 2/20 0.44
PROC P04070 1/20 0.44
KLK1 P06870 1/20 0.44
PLAT P00750 1/20 0.42
F7 P08709 1/20 0.42

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
SCHEMBL7107451 0.90 PRSS1 (0.35) PRSS1F10PRSS2PRSS3F2
Trifluoroacetic Acid SCHEMBL6179765 0.79 F10 (0.52) PRSS1F10PRSS2PRSS3F2
SCHEMBL6179772 0.77 F10 (0.47) PRSS1F10PRSS2PRSS3F2
SCHEMBL6162881 0.72 F10 (0.39) PRSS1F10PRSS2PRSS3F2
Trifluoroacetic Acid SCHEMBL6167612 0.71 F10 (0.63) PRSS1F10PRSS2PRSS3F2
SCHEMBL6162409 0.70 F10 (0.61) PRSS1F10PRSS2PRSS3F2
Trifluoroacetic Acid SCHEMBL6166404 0.69 PRSS1 (0.53) PRSS1F10PRSS2PRSS3F2
Trifluoroacetic Acid SCHEMBL7107447 0.69 PTPRB (0.46) PRSS1F10PRSS2PRSS3F2
Trifluoroacetic Acid SCHEMBL6164772 0.68 PRSS1 (0.59) PRSS1F10PRSS2PRSS3F2
Trifluoroacetic Acid SCHEMBL6166133 0.68 F10 (0.64) PRSS1F10PRSS2PRSS3F2

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-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof LG CHEM INVESTMENT LTD. (KR) 2003-04-03 US claimed
US-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof LG CHEM INVESTMENT LTD. (KR) 2003-04-03 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-20030065176-A1 Factor xa inhibitors with aryl-amidines and derivatives, and prodrugs thereof F2, F12, TFPI PRSS1 43/4885F10 11/4885PRSS2 95/4885

“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.