SCHEMBL1624971

SCHEMBL1624971

C[C@H](NC(=O)CN)C(=O)N(c1ccc2ccccc2c1)[C@@](C(=O)O)(C(=O)c1cccc(C(=N)N)c1)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F2 P00734 8/20 0.37
TMPRSS6 Q8IU80 1/20 0.37
F10 P00742 7/20 0.35
F7 P08709 4/20 0.35
PLAU P00749 3/20 0.35
PLG P00747 4/20 0.33
KLKB1 P03952 2/20 0.33
F12 P00748 1/20 0.33
PROC P04070 1/20 0.33
HPN P05981 1/20 0.33
RECQL P46063 1/20 0.33
F3 P13726 1/20 0.33
PRSS1 P07477 2/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KLK1 P06870 1/20 0.33

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
SCHEMBL1624373 0.70 PLAU (0.40) F2TMPRSS6F10F7PLAU
SCHEMBL8111444 0.67 PLAU (0.39) F2TMPRSS6F10F7PLAU
SCHEMBL1623823 0.66 PLAU (0.45) F2F10F7PLAUPLG
SCHEMBL1623653 0.66 F10 (0.43) F2F10F7PLAUPRSS1
SCHEMBL1625141 0.66 F10 (0.43) F2F10F7PLAUPRSS1
SCHEMBL1624532 0.66 PLAU (0.40) F2TMPRSS6F10F7PLAU
SCHEMBL1623850 0.65 PLAU (0.41) F2F10F7PLAUF3
SCHEMBL1625170 0.65 PLAU (0.41) F2F10PLAUPRSS1
SCHEMBL1624464 0.65 PLG (0.35) F2F10PLAUPLGKLKB1
SCHEMBL1624025 0.65 F10 (0.39) F2F10PLAUPLGKLKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7928137-B2 Meta-benzamidine derivatives as serine protease inhibitors TULARIK LIMITED (GB) 2011-04-19 US disclosed
US-20070155790-A1 Meta-benzamidine derivatives as serine protease inhibitors LIEBESCHUETZ JOHN W 2007-07-05 US disclosed
US-7220781-B2 Meta-benzamidine derivatives as serine protease inhibitors TULARIK LIMITED (GB) 2007-05-22 US disclosed
EP-1009758-B1 META-BENZAMIDINE DERIVATIVES AS SERINE PROTEASE INHIBITORS TULARIK LTD (GB) 2005-06-01 EP disclosed
US-20040143018-A1 Meta-benzamidine derivatives as serine protease inhibitors LIEBESCHUETZ JOHN WALTER (GB) 2004-07-22 US disclosed
US-6740682-B2 TREATMENT OF THROMBOTIC DISEASES, ASTHMA, EMPHYSEMA, CIRRHOSIS, ARTHRITIS, CARCINOMA, MELANOMA, RESTENOIS, ATHEROMA, TRAUMA, SHOCK AND REPERFUSION INJURY. TULARIK LIMITED (GB) 2004-05-25 US disclosed
US-20020055522-A1 Meta-benzamidine derivatives as serine protease inhibitors TULARIK LIMITED (GB) 2002-05-09 US disclosed
EP-1009758-A1 META-BENZAMIDINE DERIVATIVES AS SERINE PROTEASE INHIBITORS Protherics Molecular Design Limited (GB) 2000-06-21 EP disclosed
WO-1999011658-A1 META-BENZAMIDINE DERIVATIVES AS SERIN PROTEASE INHIBITORS PROTEUS MOLECULAR DESIGN LTD. (GB) 1999-03-11 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 (3 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-20020055522-A1 Meta-benzamidine derivatives as serine protease inhibitors SERPINE1, PEPD, PRSS1 F2 113/4885TMPRSS6 180/4885F10 378/4885
US-20070155790-A1 Meta-benzamidine derivatives as serine protease inhibitors PEPD, SERPINE1, HPN F2 103/4885TMPRSS6 147/4885F10 292/4885
US-20040143018-A1 Meta-benzamidine derivatives as serine protease inhibitors SERPINE1, PEPD, PRSS1 F2 113/4885TMPRSS6 180/4885F10 378/4885

“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.