SCHEMBL7125645

SCHEMBL7125645

CC(C)(C)NS(=O)(=O)c1ccccc1-c1ccc2c(c1)C(=O)N(CCOc1cccc(C(=N)N)c1)C2=O

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F10 P00742 13/20 0.58
PRSS1 P07477 4/20 0.50
PLG P00747 1/20 0.50
PROC P04070 1/20 0.50
KLK1 P06870 1/20 0.50
RAB9A P51151 2/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
F2 P00734 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
ALOX5AP P20292 1/20 0.42
FEN1 P39748 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
SCHEMBL7119014 0.89 F10 (0.72) F10PRSS1PLGPROCKLK1
SCHEMBL7118364 0.84 RAB9A (0.47) F10RAB9AKMT2ATDP1L3MBTL1
SCHEMBL7123485 0.73 F10 (1.00) F10PRSS1PLGPROCKLK1
SCHEMBL7129110 0.70 F10 (0.59) F10ALOX5APFEN1
SCHEMBL7118369 0.68 RAB9A (0.41) RAB9AKMT2ATDP1L3MBTL1
SCHEMBL6303558 0.67 F10 (0.84) F10PRSS1PLGPROCKLK1
SCHEMBL2206387 0.67 RAB9A (0.70) RAB9AKMT2ATDP1L3MBTL1
SCHEMBL7122855 0.67 F10 (0.71) F10PRSS1PLGPROCKLK1
SCHEMBL6303168 0.67 F10 (0.77) F10PRSS1PLGPROCKLK1
SCHEMBL7113702 0.66 F10 (1.00) F10PRSS1PLGPROCKLK1

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-20030114448-A1 Inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. 2003-06-19 US disclosed
WO-2002096873-A1 ISOINDOLE AND ISOQUINOLINE DERIVATIVES AS INHIBITORS OF FACTOR XA MILLENNIUM PHARMACEUTICALS, INC. (US) 2002-12-05 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-20030114448-A1 Inhibitors of factor Xa SERPINC1, F11, TFPI F10 7/4885PRSS1 59/4885PLG 27/4885

“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.