SCHEMBL7122636

SCHEMBL7122636

N=C(N)c1ccc(OCc2ccccc2)c(NC(=O)C(c2ccccc2)N2Cc3cc(-c4ccccc4S(N)(=O)=O)ccc3C2=O)c1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 15/20 0.49
PRSS1 P07477 5/20 0.48
F2 P00734 1/20 0.48
GAA P10253 1/20 0.44
ITGB3 P05106 1/20 0.42
ITGA2B P08514 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
SCHEMBL7128378 0.91 GAA (0.43) F10PRSS1F2GAAITGB3
SCHEMBL7124835 0.83 F10 (0.55) F10PRSS1F2
SCHEMBL7122641 0.79 GAA (0.43) GAA
SCHEMBL7127217 0.67 F10 (0.65) F10PRSS1F2
SCHEMBL7123485 0.66 F10 (1.00) F10PRSS1F2
SCHEMBL7484805 0.65 F10 (1.00) F10PRSS1F2
SCHEMBL7126469 0.65 KDM4E (0.56)
SCHEMBL7481885 0.65 F10 (1.00) F10PRSS1F2
Hydrochloric Acid SCHEMBL5091274 0.63 P2RX4 (0.53) F10PRSS1F2
SCHEMBL7116303 0.63 PRSS1 (0.59) F10PRSS1F2

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 59/4885F2 5/4885

“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.