SCHEMBL6432944

SCHEMBL6432944

N=C(N)Nc1ncc(Cl)c2ccc(S(=O)(=O)N[C@@H](Cc3ccccc3)C(=O)OC(=O)C(F)(F)F)cc12

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F2 P00734 7/20 0.42
TMPRSS6 Q8IU80 7/20 0.42
PLAU P00749 8/20 0.41
PLG P00747 4/20 0.41
PLAT P00750 2/20 0.40
MMP7 P09237 1/20 0.39
CTSL P07711 1/20 0.39
CTSS P25774 1/20 0.39
ADAMTS5 Q9UNA0 1/20 0.38
MMP2 P08253 1/20 0.38
POLB P06746 1/20 0.38

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
Trifluoroacetic Acid SCHEMBL6432939 0.90 F2 (0.47) F2TMPRSS6PLAUPLGPLAT
SCHEMBL6433471 0.87 PLAU (0.40) PLAUPLGPLATMMP7MMP2
SCHEMBL6432712 0.87 PLAU (0.46) PLAUPLGPLATCTSLCTSS
SCHEMBL6434317 0.84 PLAU (0.51) PLAUPLGPLAT
SCHEMBL6437934 0.84 PLAU (0.53) PLAUPLGPLAT
Trifluoroacetic Acid SCHEMBL6433466 0.80 MMP9 (0.46) PLAUPLGPLATMMP7MMP2
SCHEMBL6434734 0.79 PLAU (0.49) F2TMPRSS6PLAUPLGPLAT
Trifluoroacetic Acid SCHEMBL6434310 0.78 PLAU (0.63) PLAUPLGPLAT
SCHEMBL6435148 0.78 PLAU (0.55) PLAUPLGCTSLCTSS
SCHEMBL6438581 0.78 PLAU (0.51) F2TMPRSS6PLAUPLGPLAT

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
US-20050026836-A1 Composition for the treatment of damaged tissue DACK KEVIN NEIL (GB) 2005-02-03 US disclosed
US-20030199440-A1 Composition for the treatment of damaged tissue PFIZER INC. 2003-10-23 US disclosed
EP-1077945-B1 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER (US) 2003-01-08 EP disclosed
US-6093731-A Isoquinolines PFIZER INC. 2000-07-25 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 (2 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-20030199440-A1 Composition for the treatment of damaged tissue MMP1, SERPINE1, COL14A1 F2 350/4885TMPRSS6 543/4885PLAU 119/4885
US-20050026836-A1 Composition for the treatment of damaged tissue MMP1, SERPINE1, COL14A1 F2 350/4885TMPRSS6 543/4885PLAU 119/4885

“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.