SCHEMBL7126891

SCHEMBL7126891

Nc1nccc2ccc(OCCN3Cc4cc(-c5ccccc5S(N)(=O)=O)ccc4C3=O)cc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 18/20 1.00
F2 P00734 4/20 0.41
PRSS1 P07477 3/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
P2RX3 P56373 1/20 0.40

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
SCHEMBL7121923 0.90 F10 (0.81) F10
SCHEMBL7119304 0.84 F10 (0.72) F10PRSS1P2RX3
SCHEMBL7128476 0.82 F10 (1.00) F10F2PRSS1PRSS2PRSS3
SCHEMBL7122554 0.81 F10 (1.00) F10F2PRSS1PRSS2PRSS3
SCHEMBL7123485 0.79 F10 (1.00) F10F2PRSS1
SCHEMBL7119401 0.74 F10 (0.82) F10
SCHEMBL7119002 0.73 F10 (0.82) F10
SCHEMBL7121877 0.73 F10 (0.57) F10
SCHEMBL7133162 0.71 F10 (0.64) F10F2PRSS1PRSS2PRSS3
SCHEMBL7126894 0.68 F10 (0.51) F10F2

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 1 patent. 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

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 7/4885F2 5/4885PRSS1 59/4885

“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.